SCHEMBL5021159

SCHEMBL5021159

Cc1cc(F)cc(C(C)Nc2cc(N3CCNCC3)ccc2S(C)(=O)=O)c1C

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.58
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CNR1 P21554 1/20 0.40
SOS1 Q07889 8/20 0.39
ADRB1 P08588 1/20 0.38
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL5021156 0.90 HTR6 (0.61) HTR6HPGDSMN1; SMN2CNR1SOS1
SCHEMBL5053874 0.89 HTR6 (0.69) HTR6HPGDSMN1; SMN2CNR1SOS1
SCHEMBL5053800 0.82 HTR6 (0.73) HTR6HPGDSMN1; SMN2CNR1SOS1
SCHEMBL5021160 0.81 CCR2 (0.39) HTR6
SCHEMBL475664 0.78 HPGD (0.65) HTR6HPGDSMN1; SMN2CNR1MAPT
Hydrochloric Acid SCHEMBL1747995 0.77 HPGD (0.64) HTR6HPGDSMN1; SMN2CNR1MAPT
SCHEMBL1748150 0.77 HTR6 (0.56) HTR6HPGDSMN1; SMN2CNR1ADRB1
SCHEMBL1747990 0.76 HTR6 (0.68) HTR6HPGDSMN1; SMN2CNR1SOS1
SCHEMBL12528587 0.76 HTR6 (0.58) HTR6HPGDSMN1; SMN2CNR1POLB
SCHEMBL10077171 0.76 HTR6 (0.82) HTR6HPGDSMN1; SMN2CNR1SOS1

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-20120115850-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND METHODS OF TREATMENT BECKER OREN (IL) 2012-05-10 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-20120115850-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND METHODS OF TREATMENT HTR6, HTR2A, HTR3B HTR6 1/4885HPGD 2326/4885SMN1; SMN2 3858/4885

“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.