SCHEMBL9284149

SCHEMBL9284149

CBCc1ccccc1C

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 1/20 0.48
▸ ACHE P22303 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ CHRM2 P08172 1/20 0.41
▸ PTGS1 P23219 1/20 0.41
▸ PTGS2 P35354 1/20 0.41
▸ KMT2A Q03164 2/20 0.39
▸ CYP2A13 Q16696 1/20 0.38
▸ HPGD P15428 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CTBP2 P56545 1/20 0.37
▸ CYP11B1 P15538 1/20 0.37
▸ CYP11B2 P19099 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ P2RX7 Q99572 1/20 0.36
▸ SHBG P04278 1/20 0.36
▸ SMN1; SMN2 Q16637 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
SCHEMBL24542985 0.78 MPO (0.36) TAAR1ACHETSHRALDH1A1P2RX7
SCHEMBL13646987 0.75 GABRA1 (0.42) ALDH1A1MAPTSHBG
SCHEMBL275403 0.75 TAAR1 (0.43) TAAR1ACHETSHRCHRM2PTGS1
SCHEMBL16232297 0.73 TAAR1 (0.48) TAAR1ACHETSHRKMT2ACYP2A13
SCHEMBL14391961 0.73 IDO1 (0.50) TAAR1TSHRCHRM2LMNASMN1; SMN2
SCHEMBL143962 0.73 TAAR1 (0.71) TAAR1ACHETSHRCHRM2PTGS1
SCHEMBL2090458 0.73 TAAR1 (0.56) TAAR1ACHETSHRCHRM2PTGS1
SCHEMBL29477327 0.73 TAAR1 (0.56) TAAR1ACHETSHRCHRM2PTGS1
SCHEMBL14607914 0.71 TAAR1 (0.52) TAAR1TSHRKMT2AHPGDALDH1A1
SCHEMBL1584581 0.70 — —

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 2 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
WO-2012071511-A1 BENZOXAZEPINES AS INHIBITORS OF MTOR AND METHODS OF THEIR USE AND MANUFACTURE EXELIXIS, INC. (US) 2012-05-31 — — 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 (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 TAAR1 1829/4885ACHE 4686/4885TSHR 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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