SCHEMBL21764731

SCHEMBL21764731

Nc1ccc(Nc2ccccc2-c2nnn(CCO)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ LMNA P02545 3/20 0.42
▸ MAOB P27338 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ TP53 P04637 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ HPGD P15428 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ APP P05067 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ SNCA P37840 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ ADORA3 P0DMS8 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
SCHEMBL20551735 0.88 TP53 (0.49) SMN1; SMN2LMNAMAOBTP53MAPT
SCHEMBL21749262 0.88 ATM (0.43) SMN1; SMN2LMNAMAOBTSHRHSD17B10
SCHEMBL20552699 0.88 MAPT (0.42) LMNAMAOBTP53MAPTTSHR
SCHEMBL20552643 0.86 ABCG2 (0.47) SMN1; SMN2LMNAMAOBTP53MAPT
SCHEMBL20552771 0.86 MAPT (0.51) SMN1; SMN2LMNAMAOBTP53MAPT
SCHEMBL20552508 0.85 SMN1; SMN2 (0.55) SMN1; SMN2LMNANPC1RAB9ATP53
SCHEMBL25781534 0.83 ABCG2 (0.39) SMN1; SMN2LMNAMAOBTP53MAPT
SCHEMBL25788929 0.83 HPGD (0.41) SMN1; SMN2LMNATP53MAPTTSHR
SCHEMBL20552528 0.82 ATM (0.44) SMN1; SMN2MAOBTSHRHPGDKDM4E
SCHEMBL20552254 0.82 TP53 (0.42) SMN1; SMN2LMNAMAOBNPC1RAB9A

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 3 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-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 SMN1; SMN2 3160/4885LMNA 2034/4885MAOB 4177/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 SMN1; SMN2 3160/4885LMNA 2034/4885MAOB 4177/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 SMN1; SMN2 3035/4885LMNA 2451/4885MAOB 3216/4885

“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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