SCHEMBL27804403

SCHEMBL27804403

NCc1ccccc1N1CCOC1C=O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NCF1 P14598 1/20 0.38
▸ THRB P10828 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ LMNA P02545 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ GFER P55789 1/20 0.30
▸ MC4R P32245 1/20 0.30
▸ PNMT P11086 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL27975311 0.77 AKR1C3 (0.40) GAAKDM4E
SCHEMBL27660776 0.77 NCF1 (0.41) NCF1BRD4LMNAMC4RPNMT
SCHEMBL28103283 0.73 LGMN (0.31) —
SCHEMBL27947141 0.73 LMNA (0.38) LMNASMN1; SMN2
SCHEMBL27502833 0.67 NCF1 (0.58) NCF1BRD4MC4RPNMTKDM4E
SCHEMBL27935635 0.67 KDM4E (0.41) LMNAKDM4ESMN1; SMN2
SCHEMBL27583868 0.67 MAPT (0.45) THRBLMNAGAAGFERKDM4E
SCHEMBL111193 0.66 NCF1 (0.57) NCF1BRD4LMNAGAASMN1; SMN2
SCHEMBL27834649 0.66 NCF1 (0.71) NCF1MC4RPNMTKDM4ESMN1; SMN2
SCHEMBL28753504 0.65 NCF1 (0.55) NCF1BRD4GAAGFERMC4R

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
CN-1989141-B Bicyclic heterocycles as HIV integrase inhibitors BRISTOL MYERS SQUIBB CO 2010-06-16 — — CN disclosed
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