SCHEMBL23629462

SCHEMBL23629462

COC(=O)c1c(Br)c(OC)cc2cn[nH]c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 1/20 0.42
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ ADORA3 P0DMS8 1/20 0.37
▸ ADORA1 P30542 1/20 0.37
▸ HTR2A P28223 1/20 0.36
▸ HTR2C P28335 1/20 0.36
▸ MKNK1 Q9BUB5 1/20 0.36
▸ MAOB P27338 3/20 0.35
▸ MAPT P10636 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAOA P21397 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ JAK2 O60674 1/20 0.35

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
SCHEMBL4074966 0.78 TSHR (0.44) AXLRAB9AKDM4ELMNASMN1; SMN2
SCHEMBL4072321 0.73 TSHR (0.45) KDM4ELMNASMN1; SMN2TSHRALDH1A1
SCHEMBL15683151 0.72 KDM4E (0.44) AXLKDM4ELMNATSHRALDH1A1
SCHEMBL760722 0.72 TSHR (0.47) AXLNPC1RAB9ALMNASMN1; SMN2
SCHEMBL4074971 0.72 TSHR (0.44) NPC1RAB9AKDM4ELMNASMN1; SMN2
SCHEMBL4072131 0.72 TSHR (0.44) KDM4ELMNASMN1; SMN2TSHRALDH1A1
SCHEMBL31620477 0.71 TSHR (0.40) NPC1RAB9AKDM4ELMNASMN1; SMN2
SCHEMBL30444527 0.70 AXL (0.43) AXLKDM4ELMNATSHRALDH1A1
SCHEMBL23629468 0.70 AXL (0.43) AXLKDM4ELMNATSHRALDH1A1
SCHEMBL4078993 0.70 TSHR (0.47) KDM4ELMNASMN1; SMN2TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11952364-B2 TRK inhibitors useful as anticancer drugs TYLIGAND BIOSCIENCE (SHANGHAI) LIMITED (CN) 2024-04-09 — — US disclosed
CN-112739691-B TRK inhibitors as anticancer agents 泰励生物科技(上海)有限公司 2023-05-23 — — CN disclosed
US-20220388983-A1 TRK INHIBITORS USEFUL AS ANTICANCER DRUGS TYLIGAND BIOSCIENCE (SHANGHAI) LIMITED (CN) 2022-12-08 — — US disclosed
EP-3848365-A1 TRK INHIBITOR AS ANTI-CANCER DRUG Tyligand Bioscience (Shanghai) Limited (CN) 2021-07-14 — — EP disclosed
EP-3848365-A1 TRK INHIBITOR AS ANTI-CANCER DRUG Tyligand Bioscience (Shanghai) Limited (CN) 2021-07-14 — — EP disclosed
CN-112739691-A TRK inhibitors as anticancer agents 泰励生物科技(上海)有限公司 2021-04-30 — — CN 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-11952364-B2 TRK inhibitors useful as anticancer drugs NTRK1, NTRK3, MUSK AXL 187/4885NPC1 3468/4885RAB9A 2192/4885
US-20220388983-A1 TRK INHIBITORS USEFUL AS ANTICANCER DRUGS NTRK1, NTRK3, MUSK AXL 187/4885NPC1 3468/4885RAB9A 2192/4885

“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.

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