SCHEMBL10312254

SCHEMBL10312254

CS(=O)(=O)NCc1cccc(C(F)(F)F)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.57
LMNA P02545 2/20 0.51
RAB9A P51151 1/20 0.51
GALR3 O60755 1/20 0.51
EGFR P00533 1/20 0.49
MLYCD O95822 1/20 0.49
HTR2A P28223 2/20 0.49
HTR2B P41595 2/20 0.49
HTR2C P28335 1/20 0.49
TRPV4 Q9HBA0 1/20 0.48
NR3C1 P04150 1/20 0.48
MEN1 O00255 1/20 0.48
PLA2G1B P04054 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
GAA P10253 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL13154862 0.85 BRD4 (0.45) CYP19A1TRPV4KMT2A
SCHEMBL5725106 0.82 POLB (0.60) HTR2AHTR2BHTR2CTRPV4NR3C1
SCHEMBL19539152 0.81 BRD4 (0.42) CYP19A1LMNARAB9ATRPV4KMT2A
SCHEMBL6567375 0.80 CYP19A1 (0.74) CYP19A1LMNARAB9ACYP1A2CYP3A4
SCHEMBL30927212 0.80 CYP19A1 (0.74) CYP19A1LMNARAB9ACYP1A2CYP3A4
SCHEMBL30435065 0.80 KMT2A (0.54) CYP19A1KMT2A
SCHEMBL13462548 0.80 CYP19A1 (0.51) CYP19A1KMT2A
SCHEMBL21998701 0.79 BRD4 (0.41) CYP19A1TRPV4KMT2ASLC6A4
SCHEMBL2377114 0.78 HTR2A (0.53) LMNAGALR3HTR2AHTR2BHTR2C
SCHEMBL29988585 0.78 MRGPRX4 (0.57) LMNAEGFRMLYCDHTR2AHTR2B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120174324-A1 DYES FOR POLYMER COLORATION, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2012-07-12 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-20120174324-A1 DYES FOR POLYMER COLORATION, THEIR PREPARATION AND THEIR USE IK, H1-0, H1-5 CYP19A1 1150/4885LMNA 190/4885RAB9A 1952/4885

“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.