SCHEMBL25787722

SCHEMBL25787722

COCCn1nnc(-c2ccccc2Nc2ccc(C(C)(F)I)cc2)n1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 9/20 0.42
▸ ABCB1 P08183 2/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ HSD17B10 Q99714 3/20 0.42
▸ MAPT P10636 4/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ TSHR P16473 4/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ TP53 P04637 2/20 0.39
▸ HPGD P15428 2/20 0.38
▸ LMNA P02545 3/20 0.38
▸ USP2 O75604 1/20 0.38
▸ HTT P42858 1/20 0.37

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 0.92 ABCG2 (0.47) ABCG2ABCB1KMT2AMEN1HSD17B10
SCHEMBL25787729 0.89 USP2 (0.42) ABCG2ABCB1KMT2AMEN1MAPT
SCHEMBL25787720 0.89 KMT2A (0.42) ABCG2ABCB1KMT2AMEN1HSD17B10
SCHEMBL21749242 0.83 TP53 (0.44) ABCG2ABCB1MAPTSMN1; SMN2TSHR
SCHEMBL21749240 0.81 ABCG2 (0.43) ABCG2ABCB1KMT2AMEN1HSD17B10
SCHEMBL20552901 0.80 ABCG2 (0.41) ABCG2ABCB1KMT2AMEN1HSD17B10
SCHEMBL25787836 0.80 ABCG2 (0.41) ABCG2ABCB1KMT2AMEN1HSD17B10
SCHEMBL20551929 0.80 USP2 (0.48) ABCG2ABCB1KMT2AMEN1MAPT
SCHEMBL25787764 0.79 LMNA (0.42) ABCG2KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL25787518 0.79 SMN1; SMN2 (0.36) ABCG2ABCB1KMT2AMEN1HSD17B10

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 1 patent. 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 ABCG2 2217/4885ABCB1 1588/4885KMT2A 1804/4885

“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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