SCHEMBL911111

SCHEMBL911111

Cc1ccc(B(O)O)c(C)c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.36
LPL P06858 1/20 0.36
LIPG Q9Y5X9 1/20 0.36
TRPA1 O75762 1/20 0.35
ATM Q13315 1/20 0.35
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
TSHR P16473 1/20 0.32
TDP2 O95551 1/20 0.32
NSD2 O96028 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PAX8 Q06710 1/20 0.32
ENPP2 Q13822 1/20 0.31
ORAI1 Q96D31 1/20 0.31
ORAI2 Q96SN7 1/20 0.31
ORAI3 Q9BRQ5 1/20 0.31
TRPV6 Q9H1D0 1/20 0.31
NCEH1 Q6PIU2 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL3938364 0.88 CA2 (0.43) CA2LPLLIPGENPP2ORAI1
SCHEMBL21642587 0.80 ENPP2 (0.31) TRPA1ATMENPP2ORAI1ORAI2
SCHEMBL28779629 0.80 CYP1A2 (0.33) TRPA1ATMCYP1A2CYP2A6TSHR
SCHEMBL3199130 0.79 ALDH1A1 (0.42) CA2LPLLIPGTRPA1ATM
SCHEMBL7776316 0.79 TRPA1 (0.37) CA2LPLLIPGTRPA1ATM
SCHEMBL7242031 0.79 TRPA1 (0.37) CA2LPLLIPGTRPA1ATM
SCHEMBL21384955 0.77 POLB (0.41) CA2LPLLIPGTRPA1ATM
SCHEMBL5917526 0.77 CA2 (0.37) CA2LPLLIPGORAI1ORAI2
SCHEMBL5250130 0.77 POLB (0.52) CA2LPLLIPGTSHRKDM4E
SCHEMBL12877656 0.77 CA2 (0.32) CA2LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115928264-A Preparation method of metal-containing near-stoichiometric continuous silicon carbide fiber 湖南泽睿新材料有限公司 2023-04-07 CN claimed
US-8921299-B2 Detergents having acceptable color THE PROCTER & GAMBLE COMPANY (US) 2014-12-30 US claimed
CN-119716054-A Fluorescent paper chip for detecting staphylococcus aureus and preparation method and application thereof 南京师范大学 2025-03-28 CN disclosed
CN-119716050-A Fluorescent paper chip for detecting escherichia coli O157: H7 as well as preparation method and application thereof 南京师范大学 2025-03-28 CN disclosed
CN-119192137-A Inhibition of human integrin alpha4β7 莫菲克医疗股份有限公司 2024-12-27 CN disclosed
CN-112682031-B Oil field interwell tracer, tracing method and fracturing fluid 中国石油化工股份有限公司 2024-06-28 CN disclosed
WO-2024126697-A1 HIGH STRENGTH LIQUID PROTEASE FORMULATIONS NOVOZYMES A/S (DK) 2024-06-20 WO disclosed
EP-4379029-A1 POLYPEPTIDES AND COMPOSITIONS COMPRISING SUCH POLYPEPTIDES Novozymes A/S (DK) 2024-06-05 EP disclosed
EP-3647398-B1 CLEANING COMPOSITIONS CONTAINING DISPERSINS V HENKEL AG & CO KGAA (DE) 2024-05-15 EP disclosed
US-20240132808-A1 Storage-Stable Hydrolase Containing Liquids BASF SE (DE) 2024-04-25 US disclosed
EP-4305146-A1 POLYPEPTIDE VARIANTS Novozymes A/S (DK) 2024-01-17 EP disclosed
WO-2007025549-A1 STABILIZATION OF CONCENTRATED LIQUID ENZYME ADDITIVES NOVOZYMES A/S (DK) 2007-03-08 WO disclosed
EP-1341793-B1 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES INC (US) 2007-01-17 EP disclosed
EP-1732541-A2 CYCLIC COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2006-12-20 EP disclosed
WO-2005099688-A2 CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-10-27 WO disclosed
US-20040266799-A1 CRF receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC. 2004-12-30 US disclosed
US-6747034-B2 CORTICOTROPIN-RELEASING FACTOR (CRF); SUCH AS 4-CHLORO-2-METHYL-5-NITRO-8-(2,4-DICHLORO)PHENYL-1,7-NAPHTHYRIDINE FOR TREATING STROKE, ANXIETY, DEPRESSION, AND/OR IRRITABLE BOWEL SYNDROME NEUROCRINE BIOSCIENCES, INC. 2004-06-08 US disclosed
EP-1341793-A2 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO Neurocrine Biosciences, Inc. (US) 2003-09-10 EP disclosed
US-20020151557-A1 CRF receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC 2002-10-17 US disclosed
WO-2002040480-A2 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. (US) 2002-05-23 WO 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 (2 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-20040266799-A1 CRF receptor antagonists and methods relating thereto CRHR1, CRH, CRHR2 CA2 715/4885LPL 2041/4885LIPG 1114/4885
US-20020151557-A1 CRF receptor antagonists and methods relating thereto CRHR1, CRH, CRHR2 CA2 715/4885LPL 2041/4885LIPG 1114/4885

“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.