SCHEMBL11434796

SCHEMBL11434796

Cc1ccc(C(O)(c2ccc(OC(F)(F)F)cc2)c2cccnc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 9/20 0.64
▸ CYP3A4 P08684 8/20 0.60
▸ CYP3A5 P20815 8/20 0.60
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ KMT2A Q03164 1/20 0.45
▸ RORC P51449 1/20 0.42

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
SCHEMBL11437664 0.93 CYP3A4 (0.63) CYP19A1CYP3A4CYP3A5NPC1RAB9A
SCHEMBL11430409 0.86 CYP3A4 (0.56) CYP19A1CYP3A4CYP3A5NPC1RAB9A
SCHEMBL11726591 0.82 CYP3A4 (0.50) CYP19A1CYP3A4CYP3A5NPC1RAB9A
SCHEMBL11726054 0.78 CYP3A4 (0.60) CYP19A1CYP3A4CYP3A5RORC
SCHEMBL11730843 0.78 CYP3A4 (0.47) CYP19A1CYP3A4CYP3A5NPC1RAB9A
SCHEMBL11431939 0.78 CYP3A4 (0.57) CYP3A4CYP3A5NPC1RAB9A
SCHEMBL4473850 0.78 CYP19A1 (0.64) CYP19A1CYP3A4CYP3A5RAB9ARORC
SCHEMBL9794571 0.78 NPC1 (0.48) CYP19A1CYP3A4CYP3A5NPC1RAB9A
SCHEMBL11721236 0.76 CYP11B1 (0.46) CYP19A1CYP3A4CYP3A5NPC1RAB9A
SCHEMBL17171913 0.76 CYP3A4 (0.45) CYP19A1CYP3A4CYP3A5NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4194899-A HERBICIDES, FUNGICIDES, PLANT GROWTH REGULATORS ELI LILLY AND COMPANY (US) 1980-03-25 — — US disclosed
US-4110099-A INHIBITOR FOR INTERNODEL GROWTH OF PLANTS ELI LILLY AND COMPANY (US) 1978-08-29 — — US disclosed
US-RE29367-E HERBICIDES, FUNGICIDES, 5-PYRIMIDINYL ELI LILLY AND COMPANY (US) 1977-08-23 — — US disclosed
US-4002628-A HERBICIDES, PLANT FUNGICIDES, PLANT GROWTH REGULATORS ELI LILLY AND COMPANY (US) 1977-01-11 — — US disclosed
US-3967949-A Fluoroalkoxyphenyl-substituted nitrogen heterocycles as plant stunting agents ELI LILLY AND COMPANY (US) 1976-07-06 — — US disclosed
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