SCHEMBL25788929

SCHEMBL25788929

CCC(N)(N)c1ccc(Nc2ccccc2-c2nnn(CCO)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ TSHR P16473 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ LMNA P02545 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ USP2 O75604 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ MAPT P10636 4/20 0.38
▸ TP53 P04637 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ DDX3X O00571 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
SCHEMBL20552643 0.86 ABCG2 (0.47) ALDH1A1LMNASMN1; SMN2MAPTTP53
SCHEMBL25781534 0.85 ABCG2 (0.39) HPGDKMT2ATSHRALDH1A1MEN1
SCHEMBL20552771 0.84 MAPT (0.51) HPGDKMT2ATSHRALDH1A1MEN1
SCHEMBL21764731 0.83 SMN1; SMN2 (0.42) HPGDKMT2ATSHRALDH1A1MEN1
SCHEMBL21749262 0.81 ATM (0.43) KMT2ATSHRMEN1HSD17B10LMNA
SCHEMBL20551735 0.81 TP53 (0.49) HPGDKMT2ATSHRALDH1A1MEN1
SCHEMBL20552699 0.81 MAPT (0.42) HPGDKMT2ATSHRALDH1A1MEN1
SCHEMBL20552508 0.81 SMN1; SMN2 (0.55) HPGDKMT2ATSHRALDH1A1MEN1
SCHEMBL20552347 0.80 ABCG2 (0.46) ALDH1A1LMNASMN1; SMN2MAPTTP53
SCHEMBL20552353 0.79 KMT2A (0.49) KMT2ATSHRALDH1A1MEN1KDM4E

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 HPGD 1998/4885KMT2A 1804/4885TSHR 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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