SCHEMBL8203992

SCHEMBL8203992

CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)nc2)CN(c2nnnn2C)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IL2 P60568 5/20 0.41
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ GRM5 P41594 3/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ HTR1B P28222 1/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ HTR1F P30939 1/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ SCN9A Q15858 2/20 0.35

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
SCHEMBL3825246 0.88 IL2 (0.44) IL2MEN1KMT2ANPC1RAB9A
SCHEMBL988247 0.88 IL2 (0.43) IL2MEN1KMT2ANPC1RAB9A
SCHEMBL3827390 0.85 IL2 (0.41) IL2MEN1KMT2ANPC1RAB9A
SCHEMBL5005018 0.84 IL2 (0.41) IL2MEN1KMT2ANPC1RAB9A
SCHEMBL613599 0.81 IL2 (0.42) IL2MEN1KMT2ANPC1RAB9A
Hydrochloric Acid SCHEMBL616896 0.81 IL2 (0.42) IL2MEN1KMT2ANPC1RAB9A
SCHEMBL16472048 0.80 IL2 (0.37) IL2NPC1RAB9AKDM4EALDH1A1
SCHEMBL16472095 0.80 IL2 (0.37) IL2MEN1KMT2ANPC1RAB9A
SCHEMBL986843 0.80 IL2 (0.41) IL2MEN1KMT2ANPC1RAB9A
SCHEMBL3823063 0.79 L3MBTL1 (0.40) IL2MEN1KMT2AALDH1A1GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2086326-B1 CYCLOHEXENYL-ARYL COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP (US) 2014-01-08 — — EP disclosed
US-20080207641-A1 CYCLOHEXENYL-ARYL COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2008-08-28 — — US disclosed
US-20080207641-A1 CYCLOHEXENYL-ARYL COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2008-08-28 — — US disclosed
WO-2008063504-A2 CYCLOHEXENYL-ARYL COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2008-05-29 — — WO 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-20080207641-A1 CYCLOHEXENYL-ARYL COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CCR1, CCR3, CCR9 IL2 28/4885MEN1 4648/4885KMT2A 2678/4885

“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.

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