SCHEMBL16017259

SCHEMBL16017259

Cc1ccccc1C(=O)Nc1cc(F)c(-c2cn(C)nc2C(F)(F)F)cc1F

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.43
CRACR2A Q9BSW2 2/20 0.43
NTRK1 P04629 1/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
BRD4 O60885 1/20 0.42
CREBBP Q92793 1/20 0.42
MAPT P10636 3/20 0.41
C5AR1 P21730 1/20 0.41
DHODH Q02127 1/20 0.41
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
ATM Q13315 1/20 0.39
CSF1R P07333 1/20 0.39
TRPV1 Q8NER1 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
SCHEMBL14887594 0.93 TRPV1 (0.46) NTRK1KMT2AMEN1LMNAPOLB
SCHEMBL16017257 0.89 LMNA (0.47) RXFP1NTRK1KMT2ACYP2C19LMNA
SCHEMBL16017263 0.87 ATM (0.47) KMT2AMEN1MAPTSMN1; SMN2ATM
SCHEMBL16017236 0.87 LMNA (0.43) NTRK1CYP3A4CYP2C19LMNAPOLB
SCHEMBL16017289 0.86 CRACR2A (0.52) RXFP1CRACR2AKMT2AMEN1CYP3A4
SCHEMBL14887514 0.84 LMNA (0.43) RXFP1NTRK1KMT2AMEN1CYP3A4
SCHEMBL16017241 0.84 LMNA (0.46) CRACR2ANTRK1KMT2AMEN1CYP3A4
SCHEMBL16020155 0.81 BRD4 (0.41) CYP3A4CYP2C19LMNAPOLBBRD4
SCHEMBL16017238 0.81 ATM (0.49) KMT2AMEN1MAPTSMN1; SMN2ATM
SCHEMBL16020154 0.80 BRD4 (0.44) CYP3A4CYP2C19LMNAPOLBBRD4

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-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. 2014-09-11 US disclosed
US-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. 2014-09-11 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-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 RXFP1 2109/4885CRACR2A 183/4885NTRK1 4722/4885

“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.