SCHEMBL9315566

SCHEMBL9315566

CN(C)c1cccc(C(=O)Cc2cccc(I)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 1/20 0.55
▸ KMT2A Q03164 2/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ KDM4E B2RXH2 5/20 0.43
▸ LMNA P02545 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ TMEM97 Q5BJF2 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.43
▸ POLB P06746 2/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ ALOX15 P16050 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ GFER P55789 1/20 0.40

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
SCHEMBL10025189 0.85 KMT2A (0.64) RAF1KMT2AL3MBTL1KDM4ELMNA
SCHEMBL9315993 0.84 RAF1 (0.56) RAF1KMT2AL3MBTL1KDM4ELMNA
SCHEMBL9771702 0.83 RAF1 (0.52) RAF1KMT2AL3MBTL1KDM4ELMNA
SCHEMBL16173948 0.82 KMT2A (0.60) RAF1KMT2AL3MBTL1KDM4ELMNA
Hydrochloric Acid SCHEMBL9314791 0.82 RAF1 (0.51) RAF1KMT2AL3MBTL1KDM4ELMNA
SCHEMBL1439664 0.77 MAPT (0.51) L3MBTL1KDM4ESMN1; SMN2SIGMAR1ALDH1A1
SCHEMBL941088 0.75 KMT2A (0.54) RAF1KMT2AL3MBTL1KDM4ELMNA
SCHEMBL11108445 0.75 KMT2A (0.58) RAF1KMT2AL3MBTL1KDM4ELMNA
SCHEMBL20346359 0.74 POLQ (0.47) KMT2AL3MBTL1LMNAALDH1A1MAPT
SCHEMBL556208 0.73 KMT2A (0.53) RAF1KMT2AL3MBTL1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5300527-A Administering anticholinergic agents for treating the memory dysfunction HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-04-05 — — US disclosed
US-5177111-A Analgesic HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-01-05 — — US disclosed
EP-0432719-A1 Alkylamino- and alkylaminoalkyl diarylketones, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-06-19 — — EP disclosed
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