SCHEMBL11209886

SCHEMBL11209886

COc1ccc(NNC=O)cc1CCC(=O)Nn1nc2ccccc2n1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ BRD4 O60885 1/20 0.39
▸ KMT2A Q03164 6/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ HTR6 P50406 1/20 0.38
▸ MAPT P10636 1/20 0.36

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
SCHEMBL9512954 0.79 POLB (0.42) RAB9ANPC1BRD4HTR6
SCHEMBL11366139 0.61 HTR6 (0.46) RAB9ANPC1BRD4HTR6
SCHEMBL18089027 0.60 MTNR1A (0.58) RAB9ANPC1TSHRLMNATP53
SCHEMBL17054170 0.59 MTNR1A (0.56) RAB9ANPC1TSHRLMNATP53
SCHEMBL20234175 0.59 MTNR1A (0.56) RAB9ANPC1TSHRLMNATP53
SCHEMBL2967999 0.59 ALDH1A1 (0.51) TSHRSMN1; SMN2KMT2AMEN1MAPT
SCHEMBL9770278 0.59 MAPT (0.64) RAB9ANPC1LMNATP53HTT
SCHEMBL23350083 0.58 MTNR1A (0.59) RAB9ANPC1TP53KMT2AMEN1
SCHEMBL30740884 0.58 MTNR1A (0.59) RAB9ANPC1TP53KMT2AMEN1
SCHEMBL8550870 0.58 ADRA1A (0.45) TSHRHTTMAPT

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
EP-0032456-B1 METHOD FOR HIGH CONTRAST DEVELOPMENT OF PHOTOGRAPHIC ELEMENTS EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1983-02-02 — — EP disclosed
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