SCHEMBL167950

SCHEMBL167950

C=CCOC(=O)C(O)C(O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.43
CYP3A4 P08684 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
MAPT P10636 1/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
HTT P42858 1/20 0.35
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
PGD P52209 1/20 0.31
CYP2C9 P11712 1/20 0.31
PDE4A P27815 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL2363000 0.98 TSHR (0.42) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL167949 0.91 CYP3A4 (0.43) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL17338689 0.88 PDE4A (0.42) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL27669919 0.88 PDE4A (0.42) TSHRCYP3A4TDP1MAPTCACNA1B
Ammonia Solution, Strong SCHEMBL28223082 0.86 CYP3A4 (0.41) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL2363002 0.83 CYP3A4 (0.36) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL27881989 0.83 TSHR (0.40) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL6368830 0.82 TDP1 (0.41) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL8633185 0.80 MAPT (0.41) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL12191482 0.78 TDP1 (0.44) TSHRCYP3A4TDP1MAPTCACNA1B

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

Appears in 2729 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240173234-A1 SUNSCREEN COMPOSITION DSM IP ASSETS B.V. (NL) 2024-05-30 US claimed
US-20240124809-A1 REACTOR CLEANING PROCESS AND COMPOSITION MIZUHO BANK, LTD., AS ADMINISTRATIVE AGENT 2024-04-18 US claimed
EP-4349952-A1 REACTOR CLEANING PROCESS AND COMPOSITION The Goodyear Tire & Rubber Company (US) 2024-04-10 EP claimed
EP-4340804-A1 SUNSCREEN COMPOSITION COMPRISING BEMOTRIZINOL DSM IP Assets B.V. (NL) 2024-03-27 EP claimed
US-11931444-B2 Topical composition DSM IP ASSETS B.V. (NL) 2024-03-19 US claimed
US-20240082133-A1 SUNSCREEN COMPOSITION BASED ON BEMT AND TWO OR MORE PIGMENTARY UV-FILTERS DSM IP ASSETS BV (NL) 2024-03-14 US claimed
WO-2024033221-A1 SUNSCREEN COMPOSITION DSM IP ASSETS B.V. (NL) 2024-02-15 WO claimed
EP-3818973-B1 WATER-RESISTANT SOLAR COMPOSITION WITH HIGH TRIAZINE CONTENT THOREL JEAN NOEL (FR) 2024-02-07 EP claimed
US-20240009102-A1 TOPICAL COMPOSITION DSM IP ASSETS BV (NL) 2024-01-11 US claimed
EP-4288158-A1 SUNSCREEN COMPOSITION BASED ON BEMT AND TWO OR MORE PIGMENTARY UV-FILTERS DSM IP Assets B.V. (NL) 2023-12-13 EP claimed
EP-1324948-A2 CRYSTALLINE MWW-TYPE TITANOSILICATE, ITS PREPARATION AND USE THEREOF FOR PRODUCING EPOXIDES Showa Denko K.K. (JP) 2003-07-09 EP claimed
US-20030040649-A1 Crystalline mww-type titanosilicate catalyst for producing oxidized compound, production process for the catalyst, and process for producing oxidized compound by using the catalyst SHOWA DENKO K.K. (JP) 2003-02-27 US claimed
WO-2002028774-A2 CRYSTALLINE MWW-TYPE TITANOSILICATE , ITS PREPARATION AND USE THEREOF FOR PRODUCING EPOXIDES SHOWA DENKO K. K. (JP) 2002-04-11 WO claimed
JP-3159388-B2 2001-04-23 JP claimed
EP-0671975-B1 CHIRAL ADSORBENTS AND PREPARATION THEREOF AS WELL AS COMPOUNDS ON WHICH THE ADSORBENTS ARE BASED AND PREPARATION OF THESE COMPOUNDS EKA CHEMICALS AB (SE) 1998-07-22 EP claimed
EP-0671975-A1 CHIRAL ADSORBENTS AND PREPARATION THEREOF AS WELL AS COMPOUNDS ON WHICH THE ADSORBENTS ARE BASED AND PREPARATION OF THESE COMPOUNDS Eka Chemicals AB (SE) 1995-09-20 EP claimed
EP-0515622-B1 ORGANOLEPTIC COMPOSITIONS GIVAUDAN ROURE INT (CH) 1994-07-20 EP claimed
WO-1994012275-A1 CHIRAL ADSORBENTS AND PREPARATION THEREOF AS WELL AS COMPOUNDS ON WHICH THE ADSORBENTS ARE BASED AND PREPARATION OF THESE COMPOUNDS EKA NOBEL AB (SE) 1994-06-09 WO claimed
EP-0515622-A1 ORGANOLEPTIC COMPOSITIONS. GIVAUDAN ROURE INT (CH) 1992-12-02 EP claimed
WO-1992010107-A1 ORGANOLEPTIC COMPOSITIONS GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1992-06-25 WO claimed