SCHEMBL985616

SCHEMBL985616

CCCCCCOC(=O)Nc1ccc(Cc2ccc(NC(=O)OCCCCCC)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.61
NPC1 O15118 7/20 0.61
SMN1; SMN2 Q16637 7/20 0.61
HPGD P15428 4/20 0.61
MAPT P10636 3/20 0.61
ALDH1A1 P00352 2/20 0.61
MAPK1 P28482 2/20 0.61
CASP1 P29466 1/20 0.61
KDM4E B2RXH2 1/20 0.61
MCL1 Q07820 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
TSHR P16473 1/20 0.57
EPHX1 P07099 1/20 0.56
TP53 P04637 1/20 0.54
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
KMT2A Q03164 1/20 0.54
RELA Q04206 1/20 0.54
PKM P14618 1/20 0.54
CYP1A2 P05177 1/20 0.53

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
SCHEMBL1024366 1.00 RAB9A (0.61) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL10595628 1.00 RAB9A (0.61) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL981887 1.00 RAB9A (0.61) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL11662679 1.00 RAB9A (0.61) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL984289 0.98 RAB9A (0.62) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL19399318 0.97 SMN1; SMN2 (0.58) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL26886769 0.96 NPC1 (0.60) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL13931805 0.94 TSHR (0.56) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL19402843 0.94 NPC1 (0.56) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL13931804 0.94 TSHR (0.56) RAB9ANPC1SMN1; SMN2HPGDMAPT

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11124683-B2 Reactive hot melt adhesive composition H.B. FULLER COMPANY (US) 2021-09-21 US disclosed
EP-3433296-B1 REACTIVE HOT MELT ADHESIVE COMPOSITION FULLER H B CO (US) 2020-11-25 EP disclosed
US-20190264079-A1 REACTIVE HOT MELT ADHESIVE COMPOSITION JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2019-08-29 US disclosed
US-10316227-B2 Reactive hot melt adhesive composition H.B. FULLER COMPANY 2019-06-11 US disclosed
EP-2275406-B1 PROCESS FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2018-11-28 EP disclosed
WO-2017165652-A1 REACTIVE HOT MELT ADHESIVE COMPOSITION H.B. FULLER COMPANY (US) 2017-09-28 WO disclosed
US-20170275512-A1 REACTIVE HOT MELT ADHESIVE COMPOSITION JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2017-09-28 US disclosed
US-20170275512-A1 REACTIVE HOT MELT ADHESIVE COMPOSITION JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2017-09-28 US disclosed
EP-2322504-B9 PROCESS FOR THE PREPARATION OF N-SUBSTITUTED CARBAMIC ACID ESTER AND PROCESS FOR THE PREPARATION OF ISOCYANATE USING THE N-SUBSTITUTED CARBAMIC ACID ESTER ASAHI CHEMICAL IND (JP) 2017-09-06 EP disclosed
US-9637445-B2 Isocyanate production process using composition containing carbamic acid ester and aromatic hydroxy compound, and composition for transfer and storage of carbamic acid ester ASAHI KASEI CHEMICALS CORPORATION (JP) 2017-05-02 US disclosed
EP-2147909-A1 METHOD FOR PRODUCTION OF ISOCYANATE USING COMPOSITION COMPRISING CARBAMIC ACID ESTER AND AROMATIC HYDROXY COMPOUND, AND COMPOSITION FOR TRANSPORT OR STORAGE OF CARBAMIC ACID ESTER Asahi Kasei Chemicals Corporation (JP) 2010-01-27 EP disclosed
EP-2088137-A1 METHOD FOR PRODUCING ISOCYANATE Asahi Kasei Chemicals Corporation (JP) 2009-08-12 EP disclosed
EP-2088138-A1 PROCESS FOR PRODUCING ISOCYANATE Asahi Kasei Chemicals Corporation (JP) 2009-08-12 EP disclosed
EP-1792925-A1 Novel material forming supramolecular structures, process and uses National Starch and Chemical Investment Holding Corporation (US) 2007-06-06 EP disclosed
US-4594441-A Process for the preparation of urethanes BAYER AKTIENGESELLSCHAFT (DE) 1986-06-10 US disclosed
EP-0018581-B1 PROCESS FOR THE PREPARATION OF ARYL-MONO- AND/OR POLYURETHANES BASF Aktiengesellschaft (DE) 1983-05-25 EP disclosed
US-4375000-A Process for the preparation of an aryl mono-, di-, and/or polyurethane BASF AKTIENGESELLSCHAFT (DE) 1983-02-22 US disclosed
US-4330479-A ZINC OR ALUMINUM CATALYST BASF AKTIENGESELLSCHAFT (DE) 1982-05-18 US disclosed
US-4278805-A FROM AROMATIC AMINE, CARBAMATE AND ALCOHOL; METAL COMPOUND CATALYST BASF AKTIENGESELLSCHAFT (DE) 1981-07-14 US disclosed
EP-0027954-A1 Process for preparing urethanes and their use in the preparation of isocyanates BAYER AG (DE) 1981-05-06 EP disclosed