SCHEMBL7554430

SCHEMBL7554430

CN(C)Cc1cc(Cl)ccc1-c1cccc(O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.45
SLC6A4 P31645 9/20 0.45
TSHR P16473 1/20 0.43
SLC6A2 P23975 8/20 0.40
SLC6A3 Q01959 8/20 0.40
HSD17B1 P14061 4/20 0.39
HSD17B2 P37059 4/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRB2 P47870 1/20 0.38
GABRA4 P48169 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
SCHEMBL6048558 0.83 BACE1 (0.48) SLC6A4SLC6A2SLC6A3HSD17B1HSD17B2
Hydrochloric Acid SCHEMBL6048530 0.81 BACE1 (0.47) SLC6A4SLC6A2SLC6A3HSD17B1HSD17B2
SCHEMBL6048536 0.76 TAAR1 (0.57) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL28872831 0.75 TSHR (0.54) TSHRHSD17B1HSD17B2CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL6048525 0.75 TAAR1 (0.55) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL3210774 0.75 ALOX15 (0.63) SLC6A4TSHRSLC6A2SLC6A3CYP3A4
SCHEMBL12505390 0.72 ALDH1A1 (0.52) TSHRHSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL16574041 0.72 TSHR (0.50) TSHRHSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL28293144 0.72 TSHR (0.54) TSHRHSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL6048555 0.71 SRC (0.52) TAAR1SLC6A4HSD17B1HSD17B2CYP3A4

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-20020198251-A1 Substituted 2-dialkylaminoalkylbiphenyl derivatives GRUENENTHAL GMBH (DE) 2002-12-26 US claimed

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-20020198251-A1 Substituted 2-dialkylaminoalkylbiphenyl derivatives LIPA, PKD1, PKD2 TAAR1 3902/4885SLC6A4 1586/4885TSHR 4355/4885

“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.