SCHEMBL11157651

SCHEMBL11157651

CCOc1ccc(NC(=NC2CCCCC2)Nc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.53
▸ RAB9A P51151 4/20 0.53
▸ MAPT P10636 4/20 0.49
▸ LMNA P02545 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ ADRA2A P08913 1/20 0.48
▸ TAS1R3 Q7RTX0 1/20 0.47
▸ TAS1R1 Q7RTX1 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ PABPC1 P11940 1/20 0.46
▸ GAA P10253 1/20 0.46

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
SCHEMBL2740848 0.83 HPGD (0.51) RAB9AMAPTLMNASMN1; SMN2HPGD
SCHEMBL8741848 0.79 RAB9A (0.55) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL10493671 0.74 NPC1 (0.51) NPC1RAB9AMAPTSMN1; SMN2HPGD
SCHEMBL5621851 0.74 SMN1; SMN2 (0.58) RAB9AMAPTLMNASMN1; SMN2HPGD
SCHEMBL5621854 0.74 SMN1; SMN2 (0.58) RAB9AMAPTLMNASMN1; SMN2HPGD
SCHEMBL9616080 0.72 SIGMAR1 (0.59) RAB9AMAPTLMNASMN1; SMN2HPGD
SCHEMBL9616079 0.72 SIGMAR1 (0.59) RAB9AMAPTLMNASMN1; SMN2HPGD
SCHEMBL10578992 0.71 P2RX7 (0.52) RAB9ASMN1; SMN2HPGDMEN1KMT2A
SCHEMBL12443334 0.71 MAPT (0.86) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL4104467 0.71 MAPT (0.76) NPC1RAB9AMAPTLMNASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4387150-A HYDROPHOBIC GUANIDINE COMPOUND AS DEVELOPER MITSUBISHI PAPER MILLS, LTD. (JP) 1983-06-07 — — US disclosed
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