SCHEMBL43253

SCHEMBL43253

CCC(=O)Cc1cc(OC)c(C)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.51
TAAR1 Q96RJ0 2/20 0.50
AKR1C3 P42330 2/20 0.42
AKR1C2 P52895 1/20 0.42
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL30807386 1.00 CYP3A4 (0.51) CYP3A4TAAR1AKR1C3AKR1C2ALDH1A1
SCHEMBL10863112 0.90 MAPT (0.44) CYP3A4TAAR1AKR1C3AKR1C2ALDH1A1
Hydrochloric Acid SCHEMBL28274376 0.86 CYP3A4 (0.65) CYP3A4TAAR1AKR1C3AKR1C2ALDH1A1
SCHEMBL25281976 0.82 CYP3A4 (0.76) CYP3A4TAAR1HSD17B10MAPTSMN1; SMN2
SCHEMBL11328148 0.82 HSD17B10 (0.57) CYP3A4TAAR1ALDH1A1HSD17B10KDM4E
SCHEMBL14647017 0.80 HMGCR (0.42) CYP3A4AKR1C3AKR1C2ALDH1A1HPGD
SCHEMBL8153869 0.79 TAAR1 (0.62) CYP3A4TAAR1ALDH1A1HSD17B10KDM4E
SCHEMBL16527052 0.77 CYP3A4 (0.49) CYP3A4TAAR1ALDH1A1HSD17B10KDM4E
SCHEMBL14755675 0.77 NPSR1 (0.49) TAAR1ALDH1A1HSD17B10KDM4EMAPT
SCHEMBL16527146 0.76 CYP3A4 (0.47) CYP3A4TAAR1ALDH1A1HSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260028600-A1 TRANSAMINASE POLYPEPTIDES CODEXIS INC (US) 2026-01-29 US disclosed
US-12448611-B2 Transaminase polypeptides CODEXIS, INC. (US) 2025-10-21 US disclosed
US-12378537-B2 Biocatalysts and methods for synthesizing derivatives of tryptamine and tryptamine analogs CODEXIS, INC. (US) 2025-08-05 US disclosed
US-12305201-B2 Engineered biocatalysts and methods for synthesizing chiral amines CODEXIS, INC. (US) 2025-05-20 US disclosed
US-20250101389-A1 BIOCATALYSTS AND METHODS FOR THE SYNTHESIS OF SUBSTITUTED LACTAMS CODEXIS INC (US) 2025-03-27 US disclosed
US-12163162-B2 Biocatalysts and methods for the synthesis of substituted lactams CODEXIS, INC. (US) 2024-12-10 US disclosed
US-20240150732-A1 TRANSAMINASE POLYPEPTIDES INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2024-05-09 US disclosed
US-11939602-B2 Transaminase polypeptides INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2024-03-26 US disclosed
WO-2024044657-A1 BIOCATALYSTS AND METHODS THEREOF TESARO, INC. (US) 2024-02-29 WO disclosed
US-20240026401-A1 ENGINEERED BIOCATALYSTS AND METHODS FOR SYNTHESIZING CHIRAL AMINES INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2024-01-25 US disclosed
WO-2013036861-A1 BIOCATALYSTS AND METHODS FOR THE SYNTHESIS OF SUBSTITUTED LACTAMS CODEXIS, INC (US) 2013-03-14 WO disclosed
WO-2012024100-A2 PROCESS FOR PREPARING AMINOCYCLOHEXYL ETHER COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2012-02-23 WO disclosed
WO-2012024104-A2 BIOCATALYSTS AND METHODS FOR THE SYNTHESIS OF (1R,2R)-2-(3,4-DIMETHOXYPHENETHOXY)CYCLOHEXANAMINE CODEXIS, INC. (US) 2012-02-23 WO disclosed
WO-2011159910-A2 BIOCATALYSTS AND METHODS FOR THE SYNTHESIS OF (S)-3-(1-AMINOETHYL)-PHENOL CODEXIS, INC. (US) 2011-12-22 WO disclosed
EP-2385983-A2 TRANSAMINASE POLYPEPTIDES Codexis, Inc. (US) 2011-11-16 EP disclosed
US-D646886-S1 Tip of an umbrella Pro Performance Sports, L.L.C. (US) 2011-10-18 US disclosed
US-20100209981-A1 TRANSAMINASE POLYPEPTIDES CODEXIS, INC. (US) 2010-08-19 US disclosed
WO-2010081053-A2 TRANSAMINASE POLYPEPTIDES CODEXIS, INC. (US) 2010-07-15 WO disclosed
EP-1075534-B1 IMPROVEMENTS IN THE ENZYMATIC SYNTHESIS OF CHIRAL AMINES CELGRO (US) 2005-05-11 EP disclosed
US-6133018-A Enzymatic synthesis of chiral amines using -2-amino propane as amine donor CELGRO (US) 2000-10-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250101389-A1 BIOCATALYSTS AND METHODS FOR THE SYNTHESIS OF SUBSTITUTED LACTAMS BCAT1, GOT1, OAT CYP3A4 533/4885TAAR1 2941/4885AKR1C3 818/4885
US-20260028600-A1 TRANSAMINASE POLYPEPTIDES GOT1, OAT, PEPD CYP3A4 65/4885TAAR1 890/4885AKR1C3 1409/4885
US-12163162-B2 Biocatalysts and methods for the synthesis of substituted lactams BCAT1, GOT1, OAT CYP3A4 533/4885TAAR1 2941/4885AKR1C3 818/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.