SCHEMBL21749242

SCHEMBL21749242

COCCn1nnc(-c2ccccc2Nc2cccc(C(F)(F)F)c2)n1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.44
▸ ABCG2 Q9UNQ0 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ KCNK18 Q7Z418 1/20 0.43
▸ RXFP1 Q9HBX9 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ TAS2R14 Q9NYV8 1/20 0.43
▸ FYN P06241 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ ABCB1 P08183 1/20 0.41

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
SCHEMBL20552459 0.89 ABCG2 (0.47) TP53ABCG2MAPTALDH1A1SMN1; SMN2
SCHEMBL21764708 0.87 ALDH1A1 (0.44) TP53MAPTALDH1A1GAARAB9A
SCHEMBL21749307 0.86 MAPT (0.49) MAPTALDH1A1GAARAB9ASMN1; SMN2
SCHEMBL20552652 0.86 ALDH1A1 (0.46) MAPTALDH1A1GAARAB9ASMN1; SMN2
SCHEMBL20552892 0.84 ALDH1A1 (0.44) MAPTALDH1A1GAARAB9ASMN1; SMN2
SCHEMBL25787720 0.84 KMT2A (0.42) TP53ABCG2MAPTALDH1A1SMN1; SMN2
SCHEMBL25787722 0.83 ABCG2 (0.42) TP53ABCG2MAPTALDH1A1SMN1; SMN2
SCHEMBL25786417 0.82 KCNK18 (0.47) MAPTALDH1A1GAARAB9ASMN1; SMN2
SCHEMBL20553068 0.82 CYP11B1 (0.44) MAPTALDH1A1GAARAB9ASMN1; SMN2
SCHEMBL20552415 0.82 YAP1 (0.47) ABCG2RXFP1

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 5 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
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 TP53 10/4885ABCG2 3004/4885MAPT 1705/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 TP53 10/4885ABCG2 3004/4885MAPT 1705/4885
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 TP53 145/4885ABCG2 2217/4885MAPT 516/4885

“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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