SCHEMBL21749248

SCHEMBL21749248

FC(F)(F)c1ccc(Nc2ccccc2-c2nnn(CCOc3cccnc3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ TSHR P16473 1/20 0.43
▸ NPC1 O15118 1/20 0.39
▸ TNF P01375 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ NOD1 Q9Y239 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ ABCG2 Q9UNQ0 6/20 0.39
▸ NOS1 P29475 1/20 0.38
▸ CHRNB2 P17787 1/20 0.37
▸ CHRNA4 P43681 1/20 0.37
▸ PLK1 P53350 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ ABCB1 P08183 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ DDX3X O00571 1/20 0.36
▸ LMNA P02545 1/20 0.36

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
SCHEMBL25787803 0.93 USP2 (0.46) USP2ALDH1A1TSHRL3MBTL1ABCG2
SCHEMBL20551929 0.90 USP2 (0.48) USP2ALDH1A1TSHRL3MBTL1ABCG2
SCHEMBL21749260 0.86 ABCG2 (0.42) USP2TSHRNPC1RAB9AL3MBTL1
SCHEMBL25787726 0.84 USP2 (0.43) USP2ALDH1A1TSHRL3MBTL1ABCG2
SCHEMBL21749247 0.83 HIF1A (0.45) RAB9AL3MBTL1ABCG2PLK1CYP3A4
SCHEMBL21749240 0.82 ABCG2 (0.43) USP2ABCG2ABCB1MAPTSMN1; SMN2
SCHEMBL20552459 0.82 ABCG2 (0.47) ALDH1A1TSHRABCG2ABCB1MAPT
SCHEMBL25787729 0.82 USP2 (0.42) USP2ALDH1A1TSHRL3MBTL1ABCG2
SCHEMBL20552934 0.82 ABCG2 (0.42) ALDH1A1TSHRL3MBTL1ABCG2ABCB1
SCHEMBL20552901 0.81 ABCG2 (0.41) ABCG2ABCB1MAPTSMN1; SMN2DDX3X

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 USP2 3192/4885ALDH1A1 3497/4885TSHR 2644/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 USP2 3192/4885ALDH1A1 3497/4885TSHR 2644/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 USP2 2622/4885ALDH1A1 3323/4885TSHR 2680/4885

“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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