SCHEMBL16017249

SCHEMBL16017249

Cn1cc(-c2ccc(NC(=O)c3ccccc3F)cc2F)c(C(F)(F)F)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
POLB P06746 1/20 0.53
SMN1; SMN2 Q16637 6/20 0.50
PTPRC P08575 2/20 0.50
CTSL P07711 1/20 0.50
PTPN1 P18031 1/20 0.50
CTSS P25774 1/20 0.50
PTPN13 Q12923 1/20 0.50
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
TDP1 Q9NUW8 1/20 0.49
RAB9A P51151 8/20 0.48
NPC1 O15118 7/20 0.48
HPGD P15428 3/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
TLR8 Q9NR97 1/20 0.46
MAPT P10636 4/20 0.45
TP53 P04637 2/20 0.45
HTT P42858 2/20 0.45

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
SCHEMBL16017289 0.93 CRACR2A (0.52) LMNAPOLBSMN1; SMN2PTPRCCTSL
SCHEMBL16017231 0.92 LMNA (0.54) LMNAPOLBSMN1; SMN2KMT2ARAB9A
SCHEMBL14887587 0.89 CRACR2A (0.48) LMNAPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL16019815 0.86 STIM1 (0.52) LMNAPOLBBACE1BACE2
SCHEMBL16017323 0.85 CYP1A2 (0.46) LMNAPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL14887585 0.85 PTPRC (0.53) LMNASMN1; SMN2PTPRCCTSLPTPN1
SCHEMBL14887594 0.85 TRPV1 (0.46) LMNAPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL16019885 0.84 POLB (0.47) LMNAPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL16017329 0.83 LMNA (0.45) LMNAPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL14887485 0.80 CRACR2A (0.49) LMNASMN1; SMN2PTPRCCTSLPTPN1

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 LMNA 1306/4885POLB 4774/4885SMN1; SMN2 854/4885

“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.