SCHEMBL21859698

SCHEMBL21859698

CCc1ccc(Cl)cc1N1CC[C@H](N(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.46
NOTUM Q6P988 2/20 0.43
MCHR1 Q99705 2/20 0.43
NOS3 P29474 5/20 0.41
NOS1 P29475 5/20 0.41
NOS2 P35228 5/20 0.41
PIM1 P11309 1/20 0.40
PIM3 Q86V86 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
FPR1 P21462 2/20 0.40
FPR2 P25090 2/20 0.40
DDR1 Q08345 2/20 0.40
HTR3A P46098 1/20 0.40
WDR5 P61964 1/20 0.40
CXCR3 P49682 1/20 0.40
CHIT1 Q13231 1/20 0.39
CHIA Q9BZP6 1/20 0.39

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
SCHEMBL21859796 0.84 PIM1 (0.41) HRH4MCHR1PIM1PIM3PIM2
SCHEMBL22193275 0.83 HRH4 (0.47) HRH4NOTUMMCHR1HTR3A
SCHEMBL15062000 0.80 PIM1 (0.52) MCHR1PIM1PIM3PIM2HTR3A
SCHEMBL2424717 0.80 HRH4 (0.45) HRH4NOTUMMCHR1PIM1PIM3
SCHEMBL2424720 0.80 HRH4 (0.45) HRH4NOTUMMCHR1PIM1PIM3
SCHEMBL21725490 0.80 HRH4 (0.45) HRH4NOTUMMCHR1PIM1PIM3
SCHEMBL22193242 0.78 HRH4 (0.44) HRH4NOTUMDDR1
SCHEMBL22193241 0.78 HRH4 (0.44) HRH4NOTUMDDR1
SCHEMBL22193250 0.77 MAPT (0.42) NOTUMPIM1PIM3PIM2DDR1
SCHEMBL26384380 0.76 ELANE (0.39) HRH4MCHR1PIM1PIM3PIM2

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-10766877-B2 Melanocortin subtype-2 receptor (MC2R) antagonists and uses thereof Crinetics Pharmaceuticals, Inc. (US) 2020-09-08 US disclosed
US-10604507-B2 Melanocortin subtype-2 receptor (MC2R) antagonists and uses thereof Crinetics Pharmaceuticals, Inc. (US) 2020-03-31 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 (2 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-10604507-B2 Melanocortin subtype-2 receptor (MC2R) antagonists and uses thereof MC3R, MC1R, MC2R HRH4 355/4885NOTUM 4477/4885MCHR1 7/4885
US-10766877-B2 Melanocortin subtype-2 receptor (MC2R) antagonists and uses thereof MC3R, MC1R, MC2R HRH4 355/4885NOTUM 4477/4885MCHR1 7/4885

“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.