SCHEMBL4686246

SCHEMBL4686246

Cc1cc(NC(=O)O)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.53
HSP90AB1 P08238 1/20 0.53
POLB P06746 2/20 0.50
TDP1 Q9NUW8 2/20 0.46
TP53 P04637 1/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
AKR1C3 P42330 2/20 0.45
CYP1A2 P05177 3/20 0.45
MEN1 O00255 2/20 0.45
CYP2D6 P10635 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP3A4 P08684 1/20 0.45
GAA P10253 1/20 0.45
FKBP5 Q13451 1/20 0.44
PDE10A Q9Y233 1/20 0.43
TNIK Q9UKE5 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7547627 0.86 ALDH1A1 (0.59) HSP90AA1HSP90AB1POLBTDP1KMT2A
SCHEMBL10242035 0.83 MAOA (0.59) POLBTP53KMT2ANPC1RAB9A
SCHEMBL2853227 0.83 ALDH1A1 (0.64) POLBKMT2AALDH1A1NPC1RAB9A
SCHEMBL3012871 0.83 POLB (0.70) POLBTP53KMT2AALDH1A1NPC1
SCHEMBL18155290 0.82 ALOX15 (0.55) HSP90AA1HSP90AB1POLBTP53KMT2A
SCHEMBL11563350 0.82 POLB (0.53) HSP90AA1HSP90AB1POLBKMT2AALDH1A1
SCHEMBL10242069 0.82 KMT2A (0.71) HSP90AA1HSP90AB1POLBTP53KMT2A
SCHEMBL15678237 0.81 KMT2A (0.54) HSP90AA1HSP90AB1KMT2AALDH1A1NPC1
SCHEMBL9115026 0.81 NMT1 (0.63) POLBTDP1KMT2AALDH1A1GAA
SCHEMBL4689214 0.80 ALDH1A1 (0.47) HSP90AA1HSP90AB1POLBKMT2AALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4359082-A1 HER2 MUTATION INHIBITORS Array BioPharma Inc. (US) 2024-05-01 EP disclosed
US-20240124474-A1 HER2 MUTATION INHIBITORS ARRAY BIOPHARMA INC. (US) 2024-04-18 US disclosed
WO-2024059558-A1 POLYCYCLIC QUINAZOLINES FOR INHIBITION OF ERBB2 ENLIVEN INC. (US) 2024-03-21 WO disclosed
US-11834453-B2 Substituted pyrimido[5,4-d]pyrimidines as HER2 inhibitors ARRAY BIOPHARMA INC. (US) 2023-12-05 US disclosed
WO-2023111996-A1 COMPOSITIONS AND METHODS OF MAKING AND USING SMALL MOLECULES IN THE TREATMENT OF CANCER REGLAGENE HOLDING, INC. (US) 2023-06-22 WO disclosed
US-20230041385-A1 HER2 MUTATION INHIBITORS ARRAY BIOPHARMA INC. (US) 2023-02-09 US disclosed
US-20230023851-A1 HER2 MUTATION INHIBITORS ARRAY BIOPHARMA INC. (US) 2023-01-26 US disclosed
WO-2022269531-A1 HER2 MUTATION INHIBITORS ARRAY BIOPHARMA INC. (US) 2022-12-29 WO disclosed
WO-2022003575-A1 HER2 MUTATION INHIBITORS ARRAY BIOPHARMA INC. (US) 2022-01-06 WO disclosed
US-20210017134-A1 4-(METHYLAMINOPHENOXY)PYRDIN-3-YL-BENZAMIDE DERIVATIVES FOR TREATING CANCER OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2021-01-21 US disclosed
US-20180265471-A1 4-(METHYLAMINOPHENOXY)PYRDIN-3-YL-BENZAMIDE DERIVATIVES FOR TREATING CANCER OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2018-09-20 US disclosed
US-20170298023-A1 4-(METHYLAMINOPHENOXY)PYRDIN-3-YL-BENZAMIDE DERIVATIVES FOR TREATING CANCER OTSUKA PHARMA CO LTD (JP) 2017-10-19 US disclosed
US-20150105432-A1 4-(METHYLAMINOPHENOXY)PYRDIN-3-YL-BENZAMIDE DERIVATIVES FOR TREATING CANCER OTSUKA PHARMACEUTICAL CO., LTD. 2015-04-16 US disclosed
EP-2624833-B1 4-(METHYLAMINOPHENOXY)PYRDIN-3-YL-BENZAMIDE DERIVATIVES FOR TREATING CANCER OTSUKA PHARMA CO LTD (JP) 2014-12-10 EP disclosed
US-20130267565-A1 4- (METHYLAMINOPHENOXY) PYRDIN -3- YL - BENZAMIDE DERIVATIVES FOR TREATING CANCER OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-10-10 US disclosed
EP-2624833-A1 4- (METHYLAMINOPHENOXY) PYRDIN- 3 - YL - BENZAMIDE DERIVATIVES FOR TREATING CANCER Otsuka Pharmaceutical Co., Ltd. (JP) 2013-08-14 EP disclosed
WO-2012046825-A1 4- (METHYLAMINOPHENOXY) PYRDIN- 3 - YL - BENZAMIDE DERIVATIVES FOR TREATING CANCER OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-04-12 WO disclosed
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2007071840-A2 COMPOUNDS BASED ON FOUR AROMATIC RINGS, PREPARATION AND USES THEREOF CEREP (FR) 2007-06-28 WO disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150105432-A1 4-(METHYLAMINOPHENOXY)PYRDIN-3-YL-BENZAMIDE DERIVATIVES FOR TREATING CANCER HCCS, IDH2, GLS2 HSP90AA1 1441/4885HSP90AB1 1166/4885POLB 3045/4885
US-20130267565-A1 4- (METHYLAMINOPHENOXY) PYRDIN -3- YL - BENZAMIDE DERIVATIVES FOR TREATING CANCER HCCS, MDH2, IDH2 HSP90AA1 1323/4885HSP90AB1 1040/4885POLB 2853/4885
US-20230041385-A1 HER2 MUTATION INHIBITORS ERBB2, EGFR, ERBB3 HSP90AA1 1500/4885HSP90AB1 811/4885POLB 3223/4885
US-20180265471-A1 4-(METHYLAMINOPHENOXY)PYRDIN-3-YL-BENZAMIDE DERIVATIVES FOR TREATING CANCER HCCS, GLS2, IDH2 HSP90AA1 1435/4885HSP90AB1 1159/4885POLB 3031/4885
US-11834453-B2 Substituted pyrimido[5,4-d]pyrimidines as HER2 inhibitors ERBB2, EGFR, ERBB3 HSP90AA1 3295/4885HSP90AB1 2345/4885POLB 1631/4885
US-20240124474-A1 HER2 MUTATION INHIBITORS ERBB2, EGFR, ERBB3 HSP90AA1 1458/4885HSP90AB1 781/4885POLB 2914/4885
US-20170298023-A1 4-(METHYLAMINOPHENOXY)PYRDIN-3-YL-BENZAMIDE DERIVATIVES FOR TREATING CANCER IDH2, MDH2, HCCS HSP90AA1 1426/4885HSP90AB1 1141/4885POLB 2657/4885
US-20210017134-A1 4-(METHYLAMINOPHENOXY)PYRDIN-3-YL-BENZAMIDE DERIVATIVES FOR TREATING CANCER HCCS, GLS2, IDH2 HSP90AA1 1435/4885HSP90AB1 1159/4885POLB 3031/4885
US-20230023851-A1 HER2 MUTATION INHIBITORS ERBB2, EGFR, ERBB3 HSP90AA1 1458/4885HSP90AB1 781/4885POLB 2914/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.