SCHEMBL829466

SCHEMBL829466

O=C(Oc1ccccc1Br)N1CCCC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.65
ALDH1A1 P00352 5/20 0.65
GAA P10253 1/20 0.65
NPC1 O15118 5/20 0.58
RAB9A P51151 4/20 0.58
HPGD P15428 4/20 0.58
NCEH1 Q6PIU2 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
HTT P42858 1/20 0.58
TSHR P16473 2/20 0.57
TP53 P04637 3/20 0.56
TDP1 Q9NUW8 3/20 0.54
NPSR1 Q6W5P4 2/20 0.54
POLB P06746 3/20 0.53
LMNA P02545 4/20 0.52
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51

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
SCHEMBL829196 0.98 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL18297996 0.87 SMN1; SMN2 (0.76) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL829571 0.87 NCEH1 (0.51) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL21089037 0.85 TP53 (0.51) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL25243647 0.83 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL25249468 0.83 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL829640 0.83 GAA (0.64) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL20626906 0.82 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL17092968 0.82 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL25286920 0.82 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1GAANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024140690-A1 INTERMEDIATES OF SONROTOCLAX AND THE METHOD OF PREPARING THE SAME BEIGENE (SUZHOU) CO., LTD. (CN) 2024-07-04 WO disclosed
WO-2024140678-A1 A KETAL PROTECTED INTERMEDIATE FOR SONROTOCLAX AND PREPARATION METHOD THEREOF BEIGENE (SUZHOU) CO., LTD. (CN) 2024-07-04 WO disclosed
US-20240166646-A1 1H-PYRROLO[2,3-B]PYRIDINE DERIVATIVES AS BCL-2 INHIBITORS FOR THE TREATMENT OF NEOPLASTIC AND AUTOIMMUNE DISEASES NEWAVE PHARMACEUTICAL INC. 2024-05-23 US disclosed
WO-2024017354-A1 METHODS OF TREATING MULTIPLE MYELOMA USING BCL-2 INHIBITOR BEIGENE, LTD. (KY) 2024-01-25 WO disclosed
WO-2021110102-A1 METHODS OF CANCER TREATMENT USING BCL-2 INHIBITOR BEIGENE, LTD. (KY) 2021-06-10 WO disclosed
WO-2021083135-A1 Bcl-2 INHIBITORS BEIGENE, LTD. (KY) 2021-05-06 WO disclosed
EP-3788042-A1 BCL-2 INHIBITORS BeiGene, Ltd. (KY) 2021-03-10 EP disclosed
US-8143257-B2 inhibiting angiogenesis; cancer, diabetic retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, chronic inflammation or exudative macular degeneration; 4-(Hydroxy-diphenyl-methyl)-piperidine-1-carboxylic acid 1-bromo-naphthalen-2-yl ester PTC THERAPEUTICS, INC. (US) 2012-03-27 US disclosed
US-8143257-B2 inhibiting angiogenesis; cancer, diabetic retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, chronic inflammation or exudative macular degeneration; 4-(Hydroxy-diphenyl-methyl)-piperidine-1-carboxylic acid 1-bromo-naphthalen-2-yl ester PTC THERAPEUTICS, INC. (US) 2012-03-27 US disclosed
US-8143257-B2 inhibiting angiogenesis; cancer, diabetic retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, chronic inflammation or exudative macular degeneration; 4-(Hydroxy-diphenyl-methyl)-piperidine-1-carboxylic acid 1-bromo-naphthalen-2-yl ester PTC THERAPEUTICS, INC. (US) 2012-03-27 US disclosed
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production PTC THERAPEUTICS, INC. 2008-10-23 US disclosed
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production PTC THERAPEUTICS, INC. 2008-10-23 US disclosed
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production PTC THERAPEUTICS, INC. 2008-10-23 US 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-20240166646-A1 1H-PYRROLO[2,3-B]PYRIDINE DERIVATIVES AS BCL-2 INHIBITORS FOR THE TREATMENT OF NEOPLASTIC AND AUTOIMMUNE DISEASES BCL2, BCL3, BCL2L1 SMN1; SMN2 764/4885ALDH1A1 1700/4885GAA 1626/4885
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production VEGFA, FLT4, FLT1 SMN1; SMN2 4842/4885ALDH1A1 936/4885GAA 805/4885

“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.