SCHEMBL25786494

SCHEMBL25786494

CCn1nnc(-c2ccccc2Nc2ccccc2OC(C)(C)C)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.50
▸ HPGD P15428 5/20 0.50
▸ TSHR P16473 4/20 0.50
▸ MEN1 O00255 5/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ HSD17B10 Q99714 4/20 0.44
▸ KDM4E B2RXH2 4/20 0.44
▸ LMNA P02545 4/20 0.44
▸ TRPM8 Q7Z2W7 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ MAPT P10636 4/20 0.41
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ ALOX15 P16050 1/20 0.39

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
SCHEMBL20552815 0.78 MAPT (0.41) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL25786372 0.77 TSHR (0.49) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL25786557 0.76 TSHR (0.56) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL20552090 0.76 HPGD (0.53) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL25786399 0.76 TSHR (0.49) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL25781520 0.74 TSHR (0.49) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL25786389 0.71 TSHR (0.49) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL25786481 0.71 TSHR (0.49) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL25788798 0.71 TSHR (0.47) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL20552627 0.70 TSHR (0.47) ALDH1A1HPGDTSHRMEN1KMT2A

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 ALDH1A1 3323/4885HPGD 1998/4885TSHR 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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