SCHEMBL13360290

SCHEMBL13360290

CCOC(=O)C1(NCl)Cc2c(F)ccc(F)c2C1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
OPRM1 P35372 6/20 0.36
CXCR5 P32302 1/20 0.36
BRD4 O60885 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 2/20 0.34
NLRP3 Q96P20 1/20 0.34
OPRK1 P41145 4/20 0.34
OPRD1 P41143 3/20 0.34
ABCB11 O95342 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
FPR2 P25090 1/20 0.33
SCN9A Q15858 1/20 0.33
SLC22A1 O15245 1/20 0.33
SLC6A4 P31645 1/20 0.33
ADRA1A P35348 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL13360605 0.87 CXCR5 (0.42) MEN1KMT2AOPRM1CXCR5BRD4
SCHEMBL13981766 0.87 CXCR5 (0.39) MEN1KMT2AOPRM1CXCR5BRD4
SCHEMBL29203032 0.80 OPRM1 (0.40) MEN1KMT2AOPRM1BRD4SMN1; SMN2
SCHEMBL29203123 0.78 OPRM1 (0.40) MEN1KMT2AOPRM1BRD4SMN1; SMN2
SCHEMBL13328648 0.77 KMT2A (0.40) MEN1KMT2AOPRM1BRD4SMN1; SMN2
Hydrochloric Acid SCHEMBL3309890 0.76 OPRM1 (0.41) MEN1KMT2AOPRM1BRD4SMN1; SMN2
SCHEMBL13981746 0.74 CXCR5 (0.45) MEN1KMT2AOPRM1CXCR5BRD4
SCHEMBL9886521 0.73 MGAM (0.39) MEN1KMT2AOPRM1SMN1; SMN2OPRK1
SCHEMBL3309946 0.73 CXCR5 (0.54) CXCR5
SCHEMBL12203927 0.71 KMT2A (0.36) MEN1KMT2AOPRM1BRD4SMN1; SMN2

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-8569535-B2 Substituted benzoylamino-indan-2-carboxylic acids and related compounds SANOFI (FR) 2013-10-29 US disclosed
US-20100113462-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS SANOFI-AVENTIS (FR) 2010-05-06 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-20100113462-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS CXCR5, CXCR1, CCR5 MEN1 3627/4885KMT2A 4037/4885OPRM1 619/4885

“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.