SCHEMBL12844179

SCHEMBL12844179

CCc1ccc(C(=O)N2CCC2)cn1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.54
ALDH1A1 P00352 7/20 0.54
HSD17B10 Q99714 2/20 0.54
HPGD P15428 6/20 0.51
KDM4E B2RXH2 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
GRM5 P41594 6/20 0.48
POLB P06746 1/20 0.48
ALOX15 P16050 1/20 0.48
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL12844390 0.97 HRH3 (0.57) HRH3ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL21414449 0.92 POLB (0.57) HRH3ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL18199107 0.88 GRM5 (0.54) HRH3HPGDKDM4ERAB9AMEN1
SCHEMBL26421763 0.87 SIGMAR1 (0.50) HRH3HPGDRAB9ASMN1; SMN2
SCHEMBL21267333 0.87 SMN1; SMN2 (0.65) HRH3ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL23733489 0.87 HRH3 (0.54) HRH3ALDH1A1HSD17B10HPGDRAB9A
SCHEMBL16712647 0.84 HRH3 (0.72) HRH3
SCHEMBL21414447 0.83 ALDH1A1 (0.55) HRH3ALDH1A1RAB9APOLBHTT
SCHEMBL22876967 0.82 L3MBTL3 (0.65) HRH3L3MBTL1RAB9A
SCHEMBL12844641 0.81 GABRA5 (0.48) HRH3ALDH1A1HSD17B10HPGDRAB9A

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-7902373-B2 asthma; for treating prostaglandin D2 mediated diseases; e.g. 6-(3-fluorophenyl)-N-[1-(1-methyl-1H-tetrazol-5-yl)piperidin-4-yl]nicotinamide PFIZER INC (US) 2011-03-08 US disclosed
US-20080146569-A1 Nicotinamide Derivatives PFIZER INC. 2008-06-19 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-20080146569-A1 Nicotinamide Derivatives NNT, NAMPT, NADK HRH3 707/4885ALDH1A1 148/4885HSD17B10 419/4885

“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.