SCHEMBL11215377

SCHEMBL11215377

c1ccc(N=C2OCCN2c2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ CYP1A2 P05177 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ CYP17A1 P05093 1/20 0.35
▸ ATM Q13315 1/20 0.34
▸ DGAT1 O75907 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ DDB1 Q16531 1/20 0.33
▸ CRBN Q96SW2 1/20 0.33
▸ TNKS O95271 1/20 0.32

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
SCHEMBL11215376 1.00 SIGMAR1 (0.38) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL11850918 1.00 SIGMAR1 (0.38) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL11707488 0.86 SIGMAR1 (0.42) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL10534035 0.76 GRM5 (0.36) MEN1KMT2ALMNAGAAMAPT
SCHEMBL11845472 0.76 GRM5 (0.36) MEN1KMT2ALMNAGAAMAPT
SCHEMBL11157322 0.70 SMN1; SMN2 (0.37) MEN1KMT2ALMNAGAAMAPT
SCHEMBL11157294 0.70 SMN1; SMN2 (0.37) MEN1KMT2ALMNAGAAMAPT
SCHEMBL297319 0.69 MEN1 (0.54) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL4434862 0.69 ATM (0.45) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL12889079 0.69 SIGMAR1 (0.54) SIGMAR1MEN1KMT2ANPC1RAB9A

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
EP-0027197-B1 PROCESS FOR THE PRODUCTION OF ADDITION COMPOUNDS FROM CARBODIIMIDES AND COMPOUNDS CONTAINING HYDROXYL GROUPS BAYER AG (DE) 1982-08-25 — — EP disclosed
US-4321394-A Process for the production of addition compounds of carbodiimides and compounds containing hydroxyl groups BAYER AKTIENGESELLSCHAFT (DE) 1982-03-23 — — US disclosed
EP-0027197-A1 Process for the production of addition compounds from carbodiimides and compounds containing hydroxyl groups BAYER AG (DE) 1981-04-22 — — EP disclosed
US-3967965-A HETEROCYCLIC UREAS FUJI PHOTO FILM CO., LTD. (JA) 1976-07-06 — — US disclosed
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