SCHEMBL7770638

SCHEMBL7770638

C=CCNC(C)C(=O)OCCCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.49
HPGD P15428 2/20 0.49
ATM Q13315 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
RAB9A P51151 2/20 0.40
FAAH O00519 1/20 0.40
ALPG P10696 1/20 0.40
PPARG P37231 1/20 0.40
HTT P42858 1/20 0.40
NCOA2 Q15596 1/20 0.40
NCOA1 Q15788 1/20 0.40
NPC1 O15118 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
EPHX1 P07099 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
SCHEMBL7766998 0.82 ALDH1A1 (0.44) TSHRHPGDNPSR1ALDH1A1SMN1; SMN2
SCHEMBL10456801 0.82 ALDH1A1 (0.44) TSHRHPGDNPSR1ALDH1A1SMN1; SMN2
SCHEMBL7774746 0.82 TSHR (0.47) TSHRHPGDATMNPSR1ALDH1A1
SCHEMBL16155384 0.80 ALDH1A1 (0.48) TSHRHPGDATMNPSR1ALDH1A1
SCHEMBL5605327 0.78 CA14 (0.42) TSHRNPSR1ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL30998824 0.78 CA14 (0.42) TSHRNPSR1ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL26478888 0.77 TSHR (0.53) TSHRHPGDATMNPSR1ALDH1A1
SCHEMBL18510055 0.76 ALDH1A1 (0.52) TSHRHPGDATMNPSR1ALDH1A1
SCHEMBL18510017 0.76 ALDH1A1 (0.52) TSHRHPGDATMNPSR1ALDH1A1
SCHEMBL28470227 0.76 EPHX1 (0.46) NPSR1ALDH1A1ALPGPPARGHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0711813-B1 Antifouling coating composition HITACHI CHEMICAL CO LTD (JP) 2001-07-25 EP disclosed
US-5773508-A BIODEGRADABLE POLYMER OF ADDITION COPOLYMERS FOR PROTECTIVE COATINGS HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-06-30 US disclosed
EP-0711813-A2 Coating varnish composition and antifouling coating composition Hitachi Chemical Co., Ltd. (JP) 1996-05-15 EP disclosed