SCHEMBL101

SCHEMBL101

c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 1.00
CYP3A4 P08684 1/20 1.00
ESR1 P03372 4/20 0.67
ESR2 Q92731 4/20 0.67
KDM4E B2RXH2 1/20 0.50
GAA P10253 1/20 0.50
ALDH1A1 P00352 3/20 0.40
NPSR1 Q6W5P4 1/20 0.38
DRD1 P21728 2/20 0.37
TSHR P16473 4/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
ALOX12 P18054 2/20 0.35
CA12 O43570 1/20 0.35
GLA P06280 1/20 0.35
CA3 P07451 1/20 0.35
CA4 P22748 1/20 0.35
CA14 Q9ULX7 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL5028587 1.00 TDP1 (1.00) TDP1CYP3A4ESR1ESR2KDM4E
Benzene SCHEMBL6890099 1.00 TDP1 (1.00) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL2085135 1.00 TDP1 (1.00) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL1195618 0.96 TDP1 (0.92) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL22558063 0.96 TDP1 (0.92) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL25384985 0.96 TDP1 (0.92) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL22445084 0.96 TDP1 (0.92) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL20582981 0.96 TDP1 (0.92) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL521959 0.96 TDP1 (0.92) TDP1CYP3A4ESR1ESR2KDM4E
SCHEMBL11170638 0.96 TDP1 (0.92) TDP1CYP3A4ESR1ESR2KDM4E

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 350780 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6433128-B1 None US claimed
CN-119236102-A Andrographolide molecularly imprinted recessive drug carrier and preparation method thereof 南华大学 2025-01-03 CN claimed
CN-119241506-A Process for preparing dabigatran etexilate intermediate through micro-channel reactor 江苏阿尔法集团盛基药业(宿迁)有限公司 2025-01-03 CN claimed
CN-119215233-A Cerium oxide-based nano material for repairing bone defect, preparation method thereof and cerium oxide-based composite bone scaffold 南开大学 2024-12-31 CN claimed
CN-119192205-A Oligomer receptor containing bithiazole spacer, and preparation method and application thereof 山东大学 2024-12-27 CN claimed
CN-119192215-A Suzuki coupling method of B (9, 10) o-dibromo-substituted m-carborane and application thereof 华东理工大学 2024-12-27 CN claimed
WO-2024262317-A1 METHOD FOR PRODUCING HYDROPHILIC QUANTUM DOT 信越化学工業株式会社 2024-12-26 WO claimed
WO-2024261723-A1 RHENIUM COMPLEXES COMPRISING A LIGAND WITH A DISTAL INVERTED TRIGONAL PYRAMIDAL STRUCTURAL MOTIF AND USE THEROF UNIVERSIDADE NOVA DE LISBOA (PT) 2024-12-26 WO claimed
WO-2024261003-A1 NEW ASTAXANTHIN SYNTHESIS DSM IP ASSETS B.V. (NL) 2024-12-26 WO claimed
CN-118725805-B Double-component aqueous polyurethane adhesive and preparation method and application thereof 南宝树脂(佛山)有限公司 2024-12-24 CN claimed
US-3947517-A Stereoselective introduction of tetracyclines hydroxyl group at 12(a) position in synthesis of tetracyclines RESEARCH CORPORATION (US) 1976-03-30 US claimed
US-3939147-A Novel 1,2-diaza-1,5,9-cyclo dodecatrienes and 1,2-diaza-1-cyclododecenes CIBA-GEIGY CORPORATION (US) 1976-02-17 US claimed
US-3937691-A Manufacture of poly (α-olefins) BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-02-10 US claimed
US-3937718-A CARBOXYLIC ACIDS, ALCOHOLS, TERTIERY PHOSPHINES, DISULFIDES, SULFENIC ACID ESTER SANKYO COMPANY LIMITED (JA) 1976-02-10 US claimed
US-3935275-A Process for preparation of terpene flavorants and novel intermediates therefor GIVAUDAN CORPORATION (US) 1976-01-27 US claimed
US-3935165-A PHOSPHOROUS ACID OR ESTER, TRIPHENYL PHOSPHINE, STERICALLY HINDERED PHENOL DYNAMIT NOBEL AKTIENGESELLSCHAFT (DT) 1976-01-27 US claimed
US-3933777-A Method for preparing polyalkenamers BABITSKY BORIS DAVIDOVICH 1976-01-20 US claimed
US-3933861-A CODIMERIZATION OF AN ALKENE OXIDE WITH AN ALKENE IN A NOBLE METAL COMPOUND CATALYST, IODINE PROMOTER CHEVRON RESEARCH COMPANY (US) 1976-01-20 US claimed
US-3932550-A DIMERIZATION OF ISOPRENE, COORDINATION CATALYST MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JA) 1976-01-13 US claimed
US-3931336-A Production of oxyalkylated α-hydroxy acetylenic compounds BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-01-06 US claimed