SCHEMBL20552090

SCHEMBL20552090

COc1ccccc1Nc1ccccc1-c1nnn(CCO)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.53
▸ TSHR P16473 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ MAPT P10636 4/20 0.51
▸ MEN1 O00255 4/20 0.51
▸ KMT2A Q03164 4/20 0.51
▸ LMNA P02545 3/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.50
▸ KDM4E B2RXH2 4/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47

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
SCHEMBL20552815 0.85 MAPT (0.41) HPGDTSHRALDH1A1MAPTMEN1
SCHEMBL20552508 0.84 SMN1; SMN2 (0.55) HPGDTSHRALDH1A1MAPTMEN1
SCHEMBL20551663 0.83 MEN1 (0.54) HPGDTSHRALDH1A1MAPTMEN1
SCHEMBL20552627 0.82 TSHR (0.47) HPGDTSHRALDH1A1MEN1KMT2A
SCHEMBL20552691 0.81 ATM (0.51) TSHRALDH1A1MEN1KMT2ALMNA
SCHEMBL21749262 0.80 ATM (0.43) TSHRMEN1KMT2ALMNASMN1; SMN2
SCHEMBL20552269 0.79 KMT2A (0.46) HPGDTSHRALDH1A1MAPTMEN1
SCHEMBL20553220 0.79 ATM (0.44) HPGDTSHRALDH1A1MAPTMEN1
SCHEMBL20551819 0.79 ATM (0.44) HPGDTSHRALDH1A1MEN1KMT2A
SCHEMBL20552451 0.79 ATM (0.48) TSHRALDH1A1MEN1KMT2ALMNA

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 8 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
EP-3618818-A1 NON-FUSED TRICYCLIC COMPOUNDS Vivace Therapeutics, Inc. (US) 2020-03-11 — — EP 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
WO-2018204532-A1 NON-FUSED TRICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. (US) 2018-11-08 — — 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 (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 HPGD 1367/4885TSHR 2644/4885ALDH1A1 3497/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 HPGD 1367/4885TSHR 2644/4885ALDH1A1 3497/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 HPGD 1998/4885TSHR 2680/4885ALDH1A1 3323/4885

“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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