SCHEMBL2045305

SCHEMBL2045305

CCCc1cc(C)ccc1C

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.65
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
POLB P06746 2/20 0.41
NR3C1 P04150 1/20 0.38
NR3C2 P08235 1/20 0.38
GAA P10253 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
AMY1A P0DUB6 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2A6 P11509 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TP53 P04637 1/20 0.36
KMT2A Q03164 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
SCHEMBL9491792 0.87 TAAR1 (0.74) TAAR1ALDH1A1TDP1POLBGAA
SCHEMBL630179 0.86 TAAR1 (0.61) TAAR1ALDH1A1TDP1POLBNR3C1
SCHEMBL6562301 0.85 TAAR1 (0.59) TAAR1ALDH1A1TDP1POLBGAA
SCHEMBL10639347 0.83 TAAR1 (0.57) TAAR1ALDH1A1TDP1GAAKDM4E
SCHEMBL3671257 0.83 TAAR1 (0.57) TAAR1ALDH1A1TDP1GAAKDM4E
SCHEMBL9699152 0.83 TAAR1 (0.57) TAAR1ALDH1A1TDP1GAAKDM4E
SCHEMBL6549903 0.83 TAAR1 (0.57) TAAR1ALDH1A1TDP1GAAKDM4E
SCHEMBL30912801 0.83 TAAR1 (0.57) TAAR1ALDH1A1TDP1GAAKDM4E
SCHEMBL11241677 0.83 TAAR1 (0.57) TAAR1ALDH1A1TDP1GAAKDM4E
SCHEMBL3892982 0.83 TAAR1 (0.57) TAAR1ALDH1A1TDP1GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120288752-A1 ADDITIVE FOR OVERCHARGE PREVENTING OF SECONDARY BATTERY AND NONAQUEOUS ELECTROLYTE FOR SECONDARY BATTERY INCLUDING THE SAME SAMSUNG CORNING PRECISION MATERIALS CO., LTD. 2012-11-15 US claimed
EP-2523247-A1 Additive for overcharge preventing of secondary battery and non-aqueous electrolyte for secondary battery including the same Samsung Corning Precision Materials Co., Ltd. (KR) 2012-11-14 EP claimed
EP-0192492-B1 PEPTIDES CONTAINING AN ALIPHATIC-AROMATIC KETONE SIDE CHAIN THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-01-02 EP claimed
WO-2022114808-A1 NEW SMALL-MOLECULE COMPOUND FOR CONTROLLING ENDOSOMAL TOLL-LIKE RECEPTOR AND THERAPEUTIC AGENT FOR AUTOIMMUNE DISEASES USING SAME 에스앤케이테라퓨틱스 2022-06-02 WO disclosed
EP-3939981-A1 FUSED THIAZOLOPYRIMIDINE DERIVATIVES AS MNKS INHIBITORS LifeArc (GB) 2022-01-19 EP disclosed
EP-3105201-B1 ENERGY EFFICIENT FRACTIONATION PROCESS FOR SEPARATING THE REACTOR EFFLUENT FROM TOL/A9+ TRANSLAKYLATION PROCESSES BP CORP NORTH AMERICA INC (US) 2019-09-18 EP disclosed
US-10266462-B2 Energy efficient fractionation process for separating the reactor effluent from TOL/A9+ transalkylation processes BP CORPORATION NORTH AMERICA INC. (US) 2019-04-23 US disclosed
CN-105992751-B For separating the fractionation process for turning the energy efficient of reactor effluent of alkylation process from TOL/A9+ BP北美公司 2019-03-22 CN disclosed
CN-108431232-A METHODS AND COMPOSITIONS FOR NUCLEIC ACID ANALYSIS 10X 基因组学有限公司 2018-08-21 CN disclosed
US-20170050901-A1 Energy Efficient Fractionation Process for Separating the Reactor Effluent from TOL/A9+ Transalkylation Processes BP CORPORATION NORTH AMERICA INC. (US) 2017-02-23 US disclosed
US-9145522-B2 Enhanced aromatics production by low pressure end point reduction and selective hydrogenation and hydrodealkylation UOP LLC (US) 2015-09-29 US disclosed
US-20120288752-A1 ADDITIVE FOR OVERCHARGE PREVENTING OF SECONDARY BATTERY AND NONAQUEOUS ELECTROLYTE FOR SECONDARY BATTERY INCLUDING THE SAME SAMSUNG CORNING PRECISION MATERIALS CO., LTD. 2012-11-15 US disclosed
EP-2523247-A1 Additive for overcharge preventing of secondary battery and non-aqueous electrolyte for secondary battery including the same Samsung Corning Precision Materials Co., Ltd. (KR) 2012-11-14 EP disclosed
EP-2512427-A1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND A PARTICULAR ADDITIONAL INGREDIENT L'Oréal (FR) 2012-10-24 EP disclosed
WO-2011073294-A1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND A PARTICULAR ADDITIONAL INGREDIENT L'OREAL (FR) 2011-06-23 WO disclosed
US-7064139-B2 Method for treating retroviral infections UNIROYAL CHEMICAL COMPANY, INC. (US) 2006-06-20 US disclosed
US-5157182-A Conversion of ortho-ethyltoluene to indene AMOCO CORPORATION (US) 1992-10-20 US disclosed
EP-0192492-B1 PEPTIDES CONTAINING AN ALIPHATIC-AROMATIC KETONE SIDE CHAIN THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-01-02 EP disclosed
US-4677193-A GONADOTROPIN-RELEASING FACTOR ANALOGS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1987-06-30 US disclosed
EP-0192492-A2 Peptides containing an aliphatic-aromatic ketone side chain THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1986-08-27 EP disclosed