SCHEMBL25786332

SCHEMBL25786332

CCc1cccc(C(C)(C)P)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.47
TP53 P04637 1/20 0.44
CYP1A2 P05177 2/20 0.40
HTR2A P28223 2/20 0.40
HTR2B P41595 2/20 0.40
MGLL Q99685 1/20 0.40
HTR2C P28335 1/20 0.40
CYP2A6 P11509 1/20 0.40
CYP2C19 P33261 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
ADRA2C P18825 1/20 0.39
SLC6A4 P31645 1/20 0.39
ADRA1A P35348 1/20 0.39
DRD3 P35462 1/20 0.39
OPRK1 P41145 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
BCL2 P10415 1/20 0.38
RAPGEF4 Q8WZA2 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
SCHEMBL30573009 0.84 KIF11 (0.49) KIF11TP53CYP1A2HTR2AHTR2B
SCHEMBL1653927 0.84 KIF11 (0.49) KIF11TP53CYP1A2HTR2AHTR2B
SCHEMBL16105424 0.84 KIF11 (0.49) KIF11TP53CYP1A2HTR2AHTR2B
SCHEMBL11066480 0.80 KIF11 (0.46) KIF11TP53CYP1A2HTR2AHTR2B
SCHEMBL20811436 0.80 HTR2A (0.47) KIF11TP53CYP1A2HTR2AHTR2B
SCHEMBL129592 0.80 KIF11 (0.46) KIF11TP53CYP1A2HTR2AHTR2B
SCHEMBL3177646 0.80 KIF11 (0.50) KIF11TP53CYP1A2HTR2AHTR2B
SCHEMBL17805427 0.80 HTR2A (0.47) KIF11TP53CYP1A2HTR2AHTR2B
SCHEMBL18242556 0.80 MGLL (0.47) KIF11TP53CYP1A2HTR2AHTR2B
SCHEMBL4449679 0.80 ESR1 (0.46) KIF11TAAR1ACHE

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 KIF11 2547/4885TP53 145/4885CYP1A2 2548/4885

“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.