SCHEMBL21749265

SCHEMBL21749265

FC(F)(F)Oc1ccc(Nc2ccccc2-c2nnn(Cc3cccnc3)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 9/20 0.50
▸ BCR P11274 4/20 0.50
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ FLT1 P17948 2/20 0.39
▸ KDR P35968 2/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ KCNH2 Q12809 2/20 0.39
▸ OPRM1 P35372 1/20 0.39
▸ MMP1 P03956 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ MMP8 P22894 1/20 0.38
▸ MMP13 P45452 1/20 0.38

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
SCHEMBL21749272 0.89 FLT1 (0.47) ABL1BCRFLT1KDRNPC1
SCHEMBL21749247 0.87 HIF1A (0.45) CYP3A4CYP2C19RAB9AL3MBTL1
SCHEMBL25787689 0.86 HIF1A (0.38) ABL1BCRCYP3A4CYP2C19RAB9A
SCHEMBL25786602 0.86 CYP3A4 (0.40) ABL1BCRCYP3A4CYP2C19NPC1
SCHEMBL25787692 0.84 CYP3A4 (0.39) ABL1BCRCYP3A4CYP2C19RAB9A
SCHEMBL20552654 0.83 SMN1; SMN2 (0.43) ABL1BCRFLT1KDRNPC1
SCHEMBL20553560 0.82 ABL1 (0.45) ABL1BCRMAPTSMN1; SMN2L3MBTL1
SCHEMBL25786690 0.82 FLT1 (0.40) ABL1BCRFLT1KDRNPC1
SCHEMBL25786399 0.82 TSHR (0.49) ABL1BCRNPC1RAB9AMAPT
SCHEMBL20552398 0.79 MAPT (0.52) NPC1RAB9AMAPTSMN1; SMN2L3MBTL1

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 ABL1 698/4885BCR 387/4885CYP3A4 3918/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 ABL1 698/4885BCR 387/4885CYP3A4 3918/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 ABL1 4691/4885BCR 2787/4885CYP3A4 1995/4885

“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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