SCHEMBL16017241

SCHEMBL16017241

Cn1cc(-c2cc(F)c(NC(=O)c3c(F)cccc3F)cc2F)c(C(F)(F)F)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
BRD4 O60885 2/20 0.44
CREBBP Q92793 2/20 0.44
NPSR1 Q6W5P4 5/20 0.43
CYP1A2 P05177 4/20 0.43
CYP3A4 P08684 3/20 0.43
CYP2C9 P11712 3/20 0.43
CYP2C19 P33261 3/20 0.43
GAA P10253 3/20 0.43
CYP2D6 P10635 2/20 0.43
C5AR1 P21730 1/20 0.43
HPGD P15428 1/20 0.41
POLB P06746 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TRPA1 O75762 3/20 0.39
CRACR2A Q9BSW2 1/20 0.39
NTRK1 P04629 1/20 0.39
KDM4E B2RXH2 1/20 0.39
STIM1 Q13586 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
SCHEMBL16017236 0.94 LMNA (0.43) LMNABRD4CREBBPNPSR1CYP1A2
SCHEMBL16020154 0.89 BRD4 (0.44) LMNABRD4CREBBPNPSR1CYP1A2
SCHEMBL14887594 0.89 TRPV1 (0.46) LMNABRD4CREBBPGAAC5AR1
SCHEMBL14887595 0.85 ATR (0.45) GAAPOLBMEN1KMT2ASTIM1
SCHEMBL16017300 0.85 LMNA (0.43) LMNABRD4CREBBPNPSR1CYP1A2
SCHEMBL14887587 0.85 CRACR2A (0.48) LMNANPSR1CYP1A2CYP3A4CYP2C9
SCHEMBL16017259 0.84 RXFP1 (0.43) LMNABRD4CREBBPCYP3A4CYP2C19
SCHEMBL16017257 0.83 LMNA (0.47) LMNABRD4CREBBPNPSR1CYP1A2
SCHEMBL16020155 0.83 BRD4 (0.41) LMNABRD4CREBBPNPSR1CYP1A2
SCHEMBL14887593 0.80 ATR (0.43) LMNAGAAPOLBMEN1KMT2A

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 1306/4885BRD4 1839/4885CREBBP 433/4885

“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.