SCHEMBL4922344

SCHEMBL4922344

COc1ccc(-c2cc(CN(Cc3ccn(-c4ccc(C(F)(F)F)cc4)c3)C(=O)C3CCNCC3)on2)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 9/20 0.44
KCNH2 Q12809 3/20 0.41
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
CYP1A2 P05177 1/20 0.37
HPGD P15428 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
USP30 Q70CQ3 2/20 0.35
TSPO P30536 1/20 0.35
HRH1 P35367 1/20 0.35
OPRD1 P41143 1/20 0.35
P2RY14 Q15391 1/20 0.35
PPARD Q03181 1/20 0.34

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
SCHEMBL4922349 0.79 MCHR1 (0.39) MCHR1KCNH2SMN1; SMN2CYP1A2HPGD
SCHEMBL4913451 0.76 MCHR1 (0.57) MCHR1KCNH2SMN1; SMN2CYP1A2ALDH1A1
SCHEMBL4926146 0.76 MCHR1 (0.46) MCHR1KCNH2
SCHEMBL4927298 0.74 MCHR1 (0.59) MCHR1KCNH2SMN1; SMN2ALDH1A1HTT
SCHEMBL20767198 0.66 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1LMNA
SCHEMBL4924398 0.66 MCHR1 (0.39) MCHR1KCNH2
SCHEMBL27710156 0.62 MCHR1 (0.44) MCHR1KCNH2
SCHEMBL19263266 0.61 PPARD (0.45) MAPTUSP30TSPOHRH1OPRD1
SCHEMBL20767211 0.60 LMNA (0.54) SMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL19263048 0.60 SMN1; SMN2 (0.55) SMN1; SMN2CYP1A2HPGDALDH1A1HTT

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-20080306055-A1 Heterocyclic Mchr1 Antagonists And Their Use In Therapy ASTRAZENECA AB (SE) 2008-12-11 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-20080306055-A1 Heterocyclic Mchr1 Antagonists And Their Use In Therapy MCHR1, MCHR2, MC1R MCHR1 1/4885KCNH2 1440/4885CHRNB2 86/4885

“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.