SCHEMBL7970498

SCHEMBL7970498

CCCCCCCCCCCCCCCCCCNc1ccccc1[N+](=O)[O-]

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 2/20 0.68
▸ HCAR3 P49019 2/20 0.59
▸ ALDH1A1 P00352 3/20 0.55
▸ MAPT P10636 7/20 0.55
▸ SMN1; SMN2 Q16637 4/20 0.55
▸ NPC1 O15118 3/20 0.55
▸ RAB9A P51151 3/20 0.55
▸ POLB P06746 1/20 0.53
▸ PKM P14618 1/20 0.53
▸ HTT P42858 2/20 0.52
▸ LMNA P02545 3/20 0.50
▸ MAPK1 P28482 3/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ GAA P10253 1/20 0.48
▸ KMT2A Q03164 1/20 0.48

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
SCHEMBL3476711 1.00 KAT2B (0.68) KAT2BHCAR3ALDH1A1MAPTSMN1; SMN2
SCHEMBL3476402 1.00 KAT2B (0.68) KAT2BHCAR3ALDH1A1MAPTSMN1; SMN2
SCHEMBL11380052 1.00 KAT2B (0.68) KAT2BHCAR3ALDH1A1MAPTSMN1; SMN2
SCHEMBL3477027 1.00 KAT2B (0.68) KAT2BHCAR3ALDH1A1MAPTSMN1; SMN2
SCHEMBL9011355 1.00 KAT2B (0.68) KAT2BHCAR3ALDH1A1MAPTSMN1; SMN2
SCHEMBL1170743 0.98 KAT2B (0.69) KAT2BHCAR3ALDH1A1MAPTSMN1; SMN2
SCHEMBL981345 0.94 KAT2B (0.71) KAT2BHCAR3ALDH1A1MAPTSMN1; SMN2
SCHEMBL27543599 0.93 KAT2B (0.59) KAT2BHCAR3ALDH1A1MAPTSMN1; SMN2
SCHEMBL6198359 0.92 KAT2B (0.78) KAT2BALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL8720672 0.92 KAT2B (0.78) KAT2BALDH1A1MAPTSMN1; SMN2NPC1

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-6204264-B1 Benzimidazole derivative, hair growth promoter and external composition for skin using the same SHISEIDO CO., LTD. (JP) 2001-03-20 — — US disclosed
CN-1263887-A Benzimidazole derivative and hair maintaining agent, skin external use agent SHISEIDO CO LTD (JP) 2000-08-23 — — CN disclosed
EP-0989123-A1 Benzimidazole derivative, hair growth promoter and external composition for skin using the same SHISEIDO COMPANY LIMITED (JP) 2000-03-29 — — EP disclosed
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