SCHEMBL21749262

SCHEMBL21749262

OCCn1nnc(-c2ccccc2Nc2ccc(F)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ MAOB P27338 1/20 0.41
▸ POLB P06746 2/20 0.41
▸ TSHR P16473 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ LMNA P02545 1/20 0.39

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
SCHEMBL20552784 0.89 ATM (0.43) ATMMEN1KMT2AHSD17B10MAOB
SCHEMBL20552643 0.88 ABCG2 (0.47) MAOBSMN1; SMN2LMNA
SCHEMBL21764731 0.88 SMN1; SMN2 (0.42) MEN1KMT2AHSD17B10MAOBTSHR
SCHEMBL20552699 0.88 MAPT (0.42) MEN1KMT2AMAOBTSHRLMNA
SCHEMBL20551735 0.88 TP53 (0.49) MEN1KMT2AHSD17B10MAOBTSHR
SCHEMBL25786372 0.88 TSHR (0.49) MEN1KMT2AHSD17B10POLBTSHR
SCHEMBL20552528 0.87 ATM (0.44) ATMMEN1KMT2AMAOBPOLB
SCHEMBL20551925 0.87 ATM (0.41) ATMMEN1KMT2AHSD17B10MAOB
SCHEMBL20552771 0.86 MAPT (0.51) MEN1KMT2AHSD17B10MAOBTSHR
SCHEMBL20552691 0.85 ATM (0.51) ATMMEN1KMT2AHSD17B10MAOB

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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-22 — — US disclosed
US-11186554-B2 Non-fused tricyclic compounds VIVACE THERAPEUTICS, INC. (US) 2021-11-30 — — US disclosed
US-11186554-B2 Non-fused tricyclic compounds VIVACE THERAPEUTICS, INC. (US) 2021-11-30 — — US disclosed
CN-111132673-A Non-fused tricyclic compounds 维瓦斯治疗公司 2020-05-08 — — CN disclosed
US-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. 2020-02-27 — — US disclosed
US-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. 2020-02-27 — — 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 (3 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-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS YAP1, MYC, TEAD2 ATM 425/4885MEN1 3450/4885KMT2A 1927/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 ATM 425/4885MEN1 3450/4885KMT2A 1927/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 ATM 3841/4885MEN1 3125/4885KMT2A 1804/4885

“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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