SCHEMBL7258397

SCHEMBL7258397

C[C@H](Cn1ccc2ccc(Br)cc21)N(C)C

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.52
HTR2A P28223 5/20 0.52
HTR7 P34969 6/20 0.51
PRMT5 O14744 7/20 0.46
PRMT1 Q99873 1/20 0.43

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
SCHEMBL7258395 1.00 HTR2C (0.52) HTR2CHTR2AHTR7PRMT5PRMT1
SCHEMBL24142902 0.84 HTR7 (0.63) HTR2CHTR2AHTR7PRMT5PRMT1
SCHEMBL23927847 0.82 HTR2C (0.68) HTR2CHTR2AHTR7
SCHEMBL23927845 0.82 HTR2C (0.68) HTR2CHTR2AHTR7
SCHEMBL7253589 0.81 HTR2C (0.55) HTR2CHTR2AHTR7PRMT5PRMT1
SCHEMBL7253595 0.81 HTR2C (0.55) HTR2CHTR2AHTR7PRMT5PRMT1
SCHEMBL7253587 0.81 HTR2C (0.55) HTR2CHTR2AHTR7PRMT5PRMT1
SCHEMBL23956091 0.78 HTR2A (0.56) HTR2CHTR2APRMT5
SCHEMBL23927915 0.78 HTR2A (0.56) HTR2CHTR2APRMT5
SCHEMBL23927818 0.78 HTR2A (0.56) HTR2CHTR2APRMT5

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-6635639-B2 Treatment or diagnosis of central nervous system conditions NPS ALLELIX CORP. (CA) 2003-10-21 US disclosed
US-20020169322-A1 Use of N-alkylamino-heterocylic compounds for the treatment of migraine NPS ALLEXLIX CORP. 2002-11-14 US disclosed
US-6380242-B1 FOR DIAGNOSIS AND THERAPY OF CENTRAL NERVOUS SYSTEM CONDITIONS NPS ALLELIX CORP. (CA) 2002-04-30 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-20020169322-A1 Use of N-alkylamino-heterocylic compounds for the treatment of migraine CNR1, CNR2, KCNH1 HTR2C 127/4885HTR2A 425/4885HTR7 73/4885

“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.