SCHEMBL24495147

SCHEMBL24495147

CC(O)C1CCN(Cc2ccc(Br)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 3/20 0.53
POLB P06746 2/20 0.52
SIGMAR1 Q99720 1/20 0.48
IGF1R P08069 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM3 P20309 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TNIK Q9UKE5 1/20 0.44

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
SCHEMBL22804323 0.85 HTR2A (0.53) KDM4EHRH3
SCHEMBL19770184 0.84 ACHE (0.62) KDM4ESIGMAR1
SCHEMBL7651915 0.84 ACHE (0.62) KDM4ESIGMAR1
SCHEMBL30560122 0.82 HTR2A (0.42) KDM4EALDH1A1SIGMAR1
SCHEMBL12538992 0.79 ACHE (0.55) KDM4EALDH1A1
SCHEMBL4592063 0.79 ALDH1A1 (0.54) KDM4EALDH1A1SIGMAR1HRH3TNIK
SCHEMBL1927705 0.78 ALDH1A1 (0.58) KDM4EALDH1A1POLBSIGMAR1HRH3
SCHEMBL4591942 0.76 KDM4E (0.59) KDM4EALDH1A1SIGMAR1HRH3
SCHEMBL22804380 0.76 ACHE (0.55) KDM4EALDH1A1SIGMAR1HRH3TNIK
SCHEMBL29586876 0.76 KDM4E (0.58) KDM4EALDH1A1SIGMAR1SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018154-A1 NEW INDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-18 US disclosed
US-20240018154-A1 NEW INDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-18 US disclosed
WO-2022117487-A1 NEW INDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2022-06-09 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-20240018154-A1 NEW INDAZOLE DERIVATIVES CYP3A43, CYP3A4, CYP3A5 KDM4E 2371/4885ALDH1A1 364/4885POLB 4605/4885

“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.