SCHEMBL11775302

SCHEMBL11775302

O=C(c1ccccc1)c1cc(F)ccc1-n1ccnc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 7/20 0.46
▸ IDO1 P14902 1/20 0.43
▸ HCRTR1 O43613 1/20 0.42
▸ CCR3 P51677 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CD38 P28907 1/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ CYP1A2 P05177 2/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ PMP22 Q01453 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ MAPK14 Q16539 2/20 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
SCHEMBL11815461 0.84 CYP19A1 (0.61) CYP19A1IDO1MAPTL3MBTL1CYP3A4
SCHEMBL11776292 0.84 ALDH1A1 (0.56) CYP19A1IDO1MAPTKMT2AMEN1
SCHEMBL11776129 0.84 ALDH1A1 (0.53) CYP19A1IDO1MAPTCD38CYP3A4
SCHEMBL11777233 0.84 HCRTR1 (0.42) IDO1HCRTR1CCR3CD38CYP3A4
SCHEMBL11863573 0.83 MAPK14 (0.43) MAPTCYP3A4CYP1A2CYP2C9CYP2C19
SCHEMBL11802077 0.83 CYP19A1 (0.56) CYP19A1IDO1MAPTL3MBTL1CYP3A4
SCHEMBL30764860 0.81 CD38 (0.42) IDO1HCRTR1CCR3CD38CYP3A4
SCHEMBL10912944 0.80 CYP19A1 (0.64) CYP19A1MAPTCYP3A4CYP1A2CYP2D6
SCHEMBL11778364 0.76 IDO1 (0.56) CYP19A1IDO1CD38KMT2AMEN1
SCHEMBL11776810 0.76 IDO1 (0.55) IDO1CD38CYP3A4KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3941802-A 2-(Imidazol-1-yl)benzophenones THE UPJOHN COMPANY (US) 1976-03-02 — — US claimed
US-3992400-A 1-(α-Phenyl-o-tolyl)imidazoles THE UPJOHN COMPANY (US) 1976-11-16 — — US disclosed
US-3941803-A 2-(Imidazol-1-yl)benzophenones THE UPJOHN COMPANY (US) 1976-03-02 — — US disclosed
US-3941802-A 2-(Imidazol-1-yl)benzophenones THE UPJOHN COMPANY (US) 1976-03-02 — — US disclosed
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