SCHEMBL20553129

SCHEMBL20553129

CC(C)(C)NC(=O)Cn1nnc(-c2ccccc2Nc2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.61
▸ L3MBTL1 Q9Y468 3/20 0.61
▸ NPC1 O15118 1/20 0.61
▸ RAB9A P51151 1/20 0.61
▸ CYP3A4 P08684 1/20 0.57
▸ CYP2C19 P33261 1/20 0.57
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ HTT P42858 3/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ USP2 O75604 2/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ CASP1 P29466 1/20 0.53
▸ CASP7 P55210 1/20 0.53
▸ ALDH1A1 P00352 4/20 0.49
▸ LMNA P02545 4/20 0.49
▸ TP53 P04637 3/20 0.49
▸ MAPT P10636 4/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ MEN1 O00255 3/20 0.46

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
SCHEMBL21749252 0.90 TP53 (0.51) HPGDL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL20552675 0.89 TP53 (0.52) HPGDL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL21749266 0.87 LMNA (0.47) HPGDL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL20552875 0.87 ABCG2 (0.53) HPGDSMN1; SMN2HTTHSD17B10USP2
SCHEMBL20552314 0.87 LMNA (0.49) HPGDL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL20552710 0.86 KDM4E (0.52) HPGDNPC1RAB9ASMN1; SMN2HTT
SCHEMBL20552483 0.86 DDX3X (0.46) HPGDL3MBTL1NPC1RAB9ACYP3A4
SCHEMBL20552773 0.85 LMNA (0.47) HPGDL3MBTL1SMN1; SMN2HTTALDH1A1
SCHEMBL20552909 0.85 ABCG2 (0.43) HPGDL3MBTL1NPC1RAB9ACYP3A4
SCHEMBL20552393 0.85 MAPT (0.55) HPGDSMN1; SMN2HTTHSD17B10USP2

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 1367/4885L3MBTL1 1906/4885NPC1 1229/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 HPGD 1367/4885L3MBTL1 1906/4885NPC1 1229/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 HPGD 1998/4885L3MBTL1 425/4885NPC1 2127/4885

“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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