SCHEMBL9847865

SCHEMBL9847865

Cc1c(F)c(Cl)cc(NC2CC2)c1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.41
▸ ALDH1A1 P00352 6/20 0.41
▸ LMNA P02545 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ HCAR3 P49019 3/20 0.38
▸ GAA P10253 2/20 0.37
▸ GLA P06280 1/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ HTT P42858 2/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ OPRD1 P41143 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ TLR9 Q9NR96 1/20 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
SCHEMBL8657225 0.75 MAPT (0.51) MAPTALDH1A1LMNASMN1; SMN2CRHBP
SCHEMBL9847939 0.74 KMT2A (0.34) MAPTALDH1A1LMNASMN1; SMN2CRHBP
SCHEMBL9847875 0.74 ALDH1A1 (0.44) MAPTALDH1A1LMNASMN1; SMN2MAPK1
SCHEMBL8398485 0.72 HCAR3 (0.47) MAPTALDH1A1LMNASMN1; SMN2CRHBP
SCHEMBL2217900 0.72 MAPT (0.51) MAPTALDH1A1LMNASMN1; SMN2CRHBP
SCHEMBL28995655 0.72 MAPT (0.44) MAPTALDH1A1LMNASMN1; SMN2CRHBP
SCHEMBL28995768 0.71 MAPT (0.41) MAPTALDH1A1LMNASMN1; SMN2CRHBP
SCHEMBL24266297 0.70 MAPT (0.42) MAPTALDH1A1LMNASMN1; SMN2CRHBP
SCHEMBL34472545 0.70 HCAR3 (0.40) MAPTALDH1A1LMNASMN1; SMN2CRHBP
SCHEMBL21713321 0.70 MAPT (0.47) MAPTALDH1A1LMNASMN1; SMN2CRHBP

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
EP-0430847-A1 Procedure for the preparation of N-cyclopropyl-4-fluoroanilines CENTRO MARGA PARA LA INVESTIGACION S.A. (ES) 1991-06-05 — — EP claimed
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