SCHEMBL6645235

SCHEMBL6645235

Cc1ccc(C(=O)Nc2ccc(CNC(=O)c3ccccn3)cc2)c(N2CCC(C)CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 2/20 0.50
ALDH1A1 P00352 2/20 0.48
ADRB2 P07550 1/20 0.45
ADRB1 P08588 1/20 0.45
ADRB3 P13945 1/20 0.45
KDR P35968 2/20 0.44
DHODH Q02127 1/20 0.43
MAPT P10636 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
HTT P42858 1/20 0.42
KLF5 Q13887 1/20 0.42
KDM4E B2RXH2 1/20 0.42
CTNNB1 P35222 4/20 0.42
TCF7L2 Q9NQB0 4/20 0.42
HPGD P15428 2/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 2/20 0.42

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
SCHEMBL6646565 0.85 GRM4 (0.51) GRM4ALDH1A1KDRMAPTSMN1; SMN2
SCHEMBL6646885 0.84 KMT2A (0.52) ALDH1A1MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL6646205 0.83 RAB9A (0.49) GRM4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL6643855 0.81 ALDH1A1 (0.48) GRM4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL6644659 0.80 NPC1 (0.55) GRM4ALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL6649926 0.80 OGA (0.49) GRM4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL6646400 0.80 NAMPT (0.51) ALDH1A1ADRB2ADRB1ADRB3MAPT
SCHEMBL6644222 0.79 ALDH1A1 (0.47) GRM4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL6643270 0.79 ALDH1A1 (0.45) GRM4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL7199389 0.78 MAPT (0.50) ALDH1A1MAPTSMN1; SMN2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040133008-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-07-08 US disclosed
WO-2004039795-A2 AMIDE COMPOUNDS FOR THE TREATMENT OF HYPERLIPIDEMIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-13 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-20040133008-A1 Amide compounds APOB, APOL1, LDLR GRM4 2152/4885ALDH1A1 2174/4885ADRB2 23/4885

“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.