SCHEMBL5548927

SCHEMBL5548927

Cc1cc(N)ccc1Oc1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 2/20 0.41
ESR1 P03372 1/20 0.41
HSPB1 P04792 1/20 0.41
RHEB Q15382 1/20 0.41
CARM1 Q86X55 3/20 0.40
PRMT6 Q96LA8 3/20 0.40
KDM4E B2RXH2 1/20 0.40
BRD4 O60885 1/20 0.39
MRGPRX1 Q96LB2 2/20 0.38
MAP4K4 O95819 1/20 0.38
HTR1A P08908 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
PARP10 Q53GL7 1/20 0.38
CXCL8 P10145 1/20 0.38
ACHE P22303 1/20 0.38

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
SCHEMBL29549546 0.87 ALDH1A1 (0.48) MEN1KMT2AALDH1A1KDM4EHTR1A
SCHEMBL20160228 0.86 BRD4 (0.49) ALDH1A1HSPB1BRD4MAP4K4SLC6A2
SCHEMBL1583991 0.86 AR (0.42) MEN1KMT2AALDH1A1CARM1PRMT6
SCHEMBL5552568 0.85 SMN1; SMN2 (0.47) MEN1KMT2AALDH1A1KDM4EMAP4K4
SCHEMBL15821714 0.85 MEN1 (0.54) MEN1KMT2AHSPB1RHEBCARM1
SCHEMBL4329985 0.83 ALDH1A1 (0.56) MEN1KMT2AALDH1A1KDM4E
SCHEMBL30473086 0.83 ALDH1A1 (0.56) MEN1KMT2AALDH1A1KDM4E
SCHEMBL5549537 0.83 ALDH1A1 (0.41) MEN1KMT2AALDH1A1KDM4EHTR1A
SCHEMBL5553236 0.81 AR (0.50) ALDH1A1KDM4EACHE
SCHEMBL15891024 0.79 ALDH1A1 (0.41) MEN1KMT2AALDH1A1KDM4EHTR1A

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3312172-B1 AMINOPYRAZOLE DERIVATIVES USEFUL AS SRC KINASE INHIBITORS CHUGAI PHARMACEUTICAL CO LTD (JP) 2020-05-06 EP disclosed
EP-3312172-A1 AMINOPYRAZOLE DERIVATIVES Chugai Seiyaku Kabushiki Kaisha (JP) 2018-04-25 EP disclosed
WO-2016204261-A1 AMINOPYRAZOLE DERIVATIVES 中外製薬株式会社 2016-12-22 WO disclosed
EP-1147093-B1 SUBSTITUTED BICYCLIC DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PROD INC (US) 2007-04-11 EP disclosed
US-20030186995-A1 Substituted bicyclic derivatives useful as anticancer agents PFIZER INC. 2003-10-02 US disclosed
US-6541481-B2 A quinazoline compound PFIZER INC 2003-04-01 US disclosed
US-20010034351-A1 Substituted bicyclic derivatives useful as anticancer agents KATH JOHN CHARLES (US) 2001-10-25 US disclosed
EP-1147093-A1 SUBSTITUTED BICYCLIC DERIVATIVES USEFUL AS ANTICANCER AGENTS Pfizer Products Inc. (US) 2001-10-24 EP disclosed
US-6284764-B1 ANTIPROLIFERATIVE AGENT PFIZER INC. 2001-09-04 US disclosed
WO-2000044728-A1 SUBSTITUTED BICYCLIC DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PRODUCTS INC. (US) 2000-08-03 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 (2 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-20030186995-A1 Substituted bicyclic derivatives useful as anticancer agents CCNA1, MCL1, RCC1 MEN1 911/4885KMT2A 2888/4885ALDH1A1 393/4885
US-20010034351-A1 Substituted bicyclic derivatives useful as anticancer agents CCNA1, MCL1, RCC1 MEN1 911/4885KMT2A 2888/4885ALDH1A1 393/4885

“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.