SCHEMBL4497448

SCHEMBL4497448

CCCCC(CC)CO[Ti]

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
ALDH1A1 P00352 7/20 0.50
TSHR P16473 4/20 0.50
TDP1 Q9NUW8 3/20 0.50
ATM Q13315 1/20 0.50
CA2 P00918 3/20 0.45
RECQL P46063 1/20 0.41
LMNA P02545 3/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP14 P50281 1/20 0.39
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38

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
SCHEMBL28417913 1.00 CYP3A4 (0.55) CYP3A4L3MBTL1ALDH1A1TSHRTDP1
SCHEMBL9334549 0.98 CYP3A4 (0.53) CYP3A4L3MBTL1ALDH1A1TSHRTDP1
Hydrochloric Acid SCHEMBL11758478 0.98 CYP3A4 (0.53) CYP3A4L3MBTL1ALDH1A1TSHRTDP1
Hydrochloric Acid SCHEMBL4304564 0.98 CYP3A4 (0.53) CYP3A4L3MBTL1ALDH1A1TSHRTDP1
SCHEMBL27636991 0.84 LMNA (0.48) CYP3A4L3MBTL1ALDH1A1TSHRTDP1
SCHEMBL80432 0.80 CYP3A4 (0.67) CYP3A4L3MBTL1ALDH1A1TSHRTDP1
SCHEMBL5198521 0.80 CYP3A4 (0.59) CYP3A4L3MBTL1ALDH1A1TSHRTDP1
SCHEMBL1049712 0.79 CYP3A4 (0.53) CYP3A4L3MBTL1ALDH1A1TSHRTDP1
Hydrochloric Acid SCHEMBL10581347 0.79 ALDH1A1 (0.54) CYP3A4L3MBTL1ALDH1A1TSHRTDP1
SCHEMBL186004 0.79 CYP3A4 (0.53) CYP3A4L3MBTL1ALDH1A1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119954990-A Titanium catalyst component for ethylene polymerization, catalyst, preparation and application thereof 中国石油化工股份有限公司 2025-05-09 CN claimed
CN-119912606-A Catalyst suitable for ethylene polymerization reaction and preparation method and application thereof 中国石油化工股份有限公司 2025-05-02 CN claimed
CN-116162247-A Curable condensation compounds based on alkoxy-functional polysiloxanes 赢创运营有限公司 2023-05-26 CN claimed
CN-112126046-B Carbon dioxide-based copolyester and preparation method and application thereof 华峰集团有限公司 2022-10-21 CN claimed
CN-111742430-A Core-shell nanoparticles and their use in electrochemical cells 新加坡科技研究局 2020-10-02 CN claimed
CN-103846988-B A kind of preparation method of timber/nanometer titanium dioxide composite material 福州大学 2016-08-24 CN claimed
CN-102858894-B Corrosion-resistant coating and method for producing same UNIVERSITY OF HAWAII (US) 2016-05-04 CN claimed
CN-105348994-A Anticorrosive paint NANJING CHANGJIANG PAINT CO LTD 2016-02-24 CN claimed
CN-102711980-B Ziegler-natta catalyst systems and the polymer formed by it FINA TECHNOLOGY, INC. (US) 2015-08-19 CN claimed
CN-102869683-B Formation of ziegler-natta catalyst using non-blended components FINA TECHNOLOGY 2015-06-10 CN claimed
CN-102443155-A Preparation method of aliphatic-aromatic copolyester CHINA PETROLEUM & CHEMICAL 2012-05-09 CN claimed
CN-102443157-A Preparation method of aliphatic-aromatic copolyester CHINA PETROLEUM & CHEMICAL 2012-05-09 CN claimed
CN-102300904-A Method for producing polylactic acid 2011-12-28 CN claimed
CN-102046692-A Solid phase polymerization of polyesters with phosphinic acid compounds BASF SE 2011-05-04 CN claimed
CN-101687984-A Solid state polymerization process for polyester BASF SE 2010-03-31 CN claimed
US-7618913-B2 Coordination catalyst containing an organosilicon compound , nitrogen compound, transition metal compound and magnesiumon compound on catalyst support FORMOSA PLASTICS CORPORATION, U.S.A. (US) 2009-11-17 US claimed
CN-101472960-A Olefin polymerization process EQUISTAR CHEM LP (US) 2009-07-01 CN claimed
WO-2008027479-A2 HIGHLY ACTIVE ALPHA-OLEFIN COPOLYMERIZATION CATALYST SYSTEM FORMOSA PLASTICS CORPORATION, U.S.A. (US) 2008-03-06 WO claimed
US-20080058198-A1 Highly active alpha-olefin copolymerization catalyst system FORMOSA PLASTICS CORPORATION, U.S.A. 2008-03-06 US claimed
US-5371116-A Long self life SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-12-06 US claimed