SCHEMBL50019

SCHEMBL50019

Cc1cccc(P(c2ccccc2)c2cccc(C)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.60
CYP3A4 P08684 1/20 0.60
ACHE P22303 6/20 0.52
TSHR P16473 3/20 0.48
LMNA P02545 1/20 0.48
ALOX12 P18054 1/20 0.48
NPSR1 Q6W5P4 1/20 0.46
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
ALDH1A1 P00352 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
TP53 P04637 1/20 0.38
ACP3 P15309 1/20 0.37
POLB P06746 1/20 0.37
CYP2A6 P11509 1/20 0.37

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
SCHEMBL50087 1.00 TDP1 (0.60) TDP1CYP3A4ACHETSHRLMNA
SCHEMBL29535020 1.00 TDP1 (0.60) TDP1CYP3A4ACHETSHRLMNA
SCHEMBL29415924 0.92 ACHE (0.61) TDP1CYP3A4ACHETSHRLMNA
SCHEMBL49786 0.92 ACHE (0.61) TDP1CYP3A4ACHETSHRLMNA
SCHEMBL18423870 0.90 ACHE (0.58) TDP1CYP3A4ACHETSHRLMNA
Bromide SCHEMBL8849644 0.90 ACHE (0.58) TDP1CYP3A4ACHETSHRLMNA
Hydrochloric Acid SCHEMBL4529394 0.90 ACHE (0.58) TDP1CYP3A4ACHETSHRLMNA
SCHEMBL5713327 0.90 ACHE (0.58) TDP1CYP3A4ACHETSHRLMNA
SCHEMBL8849287 0.90 ACHE (0.58) TDP1CYP3A4ACHETSHRLMNA
Hydrochloric Acid SCHEMBL29001481 0.90 ACHE (0.58) TDP1CYP3A4ACHETSHRLMNA

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108003092-B Synthetic method of 2, 3-dichloropyridine 重庆中邦科技有限公司 2021-04-02 CN claimed
CN-108003092-B Synthetic method of 2, 3-dichloropyridine 重庆中邦科技有限公司 2021-04-02 CN disclosed
US-20180244865-A1 INCREASED EFFICIENCY DESULFURIZATION REAGENTS ARLANXEO DEUTSCHLAND GMBH (DE) 2018-08-30 US disclosed
EP-3341432-A1 INCREASED EFFICIENCY DESULFURIZATION REAGENTS ARLANXEO Deutschland GmbH (DE) 2018-07-04 EP disclosed
WO-2017036721-A1 INCREASED EFFICIENCY DESULFURIZATION REAGENTS ARLANXEO DEUTSCHLAND GMBH (DE) 2017-03-09 WO disclosed
EP-3135712-A1 INCREASED EFFICIENCY OF DESULFURIZATION REAGENTS ARLANXEO Deutschland GmbH (DE) 2017-03-01 EP disclosed
US-20130042972-A1 Dual Cure Thermally Conductive Adhesive THE BERGQUIST COMPANY 2013-02-21 US disclosed
WO-2013025849-A1 DUAL CURE THERMALLY CONDUCTIVE ADHESIVE THE BERGQUIST COMPANY (US) 2013-02-21 WO disclosed
US-8129467-B2 Curing accelerating compound-silica composite material, method for producing curing accelerating compound-silica composite material, curing accelerator, curable resin composition, and electronic component device HITACHI CHEMICAL CO., LTD. (JP) 2012-03-06 US disclosed
US-20090062460-A1 CURING ACCELERATING COMPOUND-SILICA COMPOSITE MATERIAL, METHOD FOR PRODUCING CURING ACCELERATING COMPOUND-SILICA COMPOSITE MATERIAL, CURING ACCELERATOR, CURABLE RESIN COMPOSITION, AND ELECTRONIC COMPONENT DEVICE HITACHI CHEMICAL CO., LTD. (JP) 2009-03-05 US disclosed
US-6825280-B1 RIGIDITY, NONWARPING, NONBLEEDING, ANTISTATIC AGENTS, WEATHERPROOF, IMPACT STRENGTH; OXIDATION AND HEAT RESISTANCE JAPAN POLYCHEM CORPORATION (JP) 2004-11-30 US disclosed
EP-1002814-A1 PROPYLENE BLOCK COPOLYMER AND PROPYLENE RESIN COMPOSITION Japan Polychem Corporation (JP) 2000-05-24 EP disclosed
US-4257973-A USING ORGANOPHOSPHORUS-PALLADIUM HALIDE COORDINATION CATALYST E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-03-24 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 (1 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-20090062460-A1 CURING ACCELERATING COMPOUND-SILICA COMPOSITE MATERIAL, METHOD FOR PRODUCING CURING ACCELERATING COMPOUND-SILICA COMPOSITE MATERIAL, CURING ACCELERATOR, CURABLE RESIN COMPOSITION, AND ELECTRONIC COMPONENT DEVICE NCAPH, RAD51, H1-2 TDP1 2981/4885CYP3A4 3968/4885ACHE 3068/4885

“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.