SCHEMBL30147

SCHEMBL30147

C[C@@H]([C@H](C)P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
CYP3A4 P08684 1/20 0.45
ESR1 P03372 4/20 0.37
ESR2 Q92731 4/20 0.37
TAAR1 Q96RJ0 4/20 0.33
SLC6A2 P23975 2/20 0.33
LMNA P02545 2/20 0.33
MAOA P21397 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
TSHR P16473 1/20 0.33
ALOX12 P18054 1/20 0.33
ACHE P22303 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
CYP2A6 P11509 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
ADRA2A P08913 1/20 0.32
ADRA2C P18825 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL29178 1.00 TDP1 (0.45) TDP1CYP3A4ESR1ESR2TAAR1
SCHEMBL4249541 1.00 TDP1 (0.45) TDP1CYP3A4ESR1ESR2TAAR1
SCHEMBL12584889 1.00 TDP1 (0.45) TDP1CYP3A4ESR1ESR2TAAR1
SCHEMBL31588 1.00 TDP1 (0.45) TDP1CYP3A4ESR1ESR2TAAR1
SCHEMBL18832827 1.00 TDP1 (0.45) TDP1CYP3A4ESR1ESR2TAAR1
SCHEMBL30366682 0.97 TDP1 (0.43) TDP1CYP3A4ESR1ESR2TAAR1
Hydrochloric Acid SCHEMBL10627881 0.95 TDP1 (0.41) TDP1CYP3A4ESR1ESR2TAAR1
SCHEMBL10627887 0.90 TDP1 (0.38) TDP1CYP3A4ESR1ESR2
SCHEMBL14713495 0.89 TDP1 (0.41) TDP1CYP3A4ESR1ESR2TAAR1
SCHEMBL18294158 0.89 TDP1 (0.41) TDP1CYP3A4ESR1ESR2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250074854-A1 PROCESS FOR THE SELECTIVE CATALYTIC HYDROGENATION OF DIENONES BASF SE (DE) 2025-03-06 US claimed
CN-119462502-A Tenapanol Process for the preparation of intermediates 杭州善礼生物医药科技有限公司 2025-02-18 CN claimed
EP-4463433-A2 PROCESS FOR THE SELECTIVE CATALYTIC HYDROGENATION OF DIENONES BASF SE (DE) 2024-11-20 EP claimed
WO-2023137133-A2 PROCESS FOR THE SELECTIVE CATALYTIC HYDROGENATION OF DIENONES BASF SE (DE) 2023-07-20 WO claimed
US-11390585-B2 Quaternary heteroatom containing compounds CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2022-07-19 US claimed
EP-3998271-A2 PENTACYCLIC DIAMIDES WITH OPTOELECTRONIC APPLICATIONS, METHODS TO PRODUCE THEM AND USES THEREOF UNIVERSIDADE NOVA DE LISBOA (PT) 2022-05-18 EP claimed
CN-111909065-B Method for alpha-methylation of aryl benzyl sulfone compound 浙江工业大学 2022-04-22 CN claimed
US-8487109-B2 Process for the palladium-catalyzed coupling of terminal alkynes with aryl tosylates SANOFI (FR) 2013-07-16 US claimed
US-8420812-B2 Process for the palladium-catalyzed coupling of terminal alkynes with heteroaryl tosylates and heteroaryl benzenesulfonates SANOFI (FR) 2013-04-16 US claimed
EP-2176203-B1 A PROCESS FOR THE PALLADIUM-CATALYZED COUPLING OF TERMINAL ALKYNES WITH ARYL TOSYLATES SANOFI SA (FR) 2011-08-10 EP claimed
US-20070203195-A1 Transition metal mediated oxidation of hetero atoms in organic molecules coordinated to transition metals PRAKTIKATALYST PHARMA, LLC 2007-08-30 US claimed
EP-1747224-A1 COMPLEXES OF RUTHENIUM WITH 2-(AMINOMETHYL)PYRIDINES AND PHOSPHINES, THEIR PREPARATION AND USE AS CATALYSTS Universita' Degli Studi di Udine (IT) 2007-01-31 EP claimed
WO-2005105819-A1 COMPLEXES OF RUTHENIUM WITH 2-(AMINOMETHYL)PYRIDINES AND PHOSPHINES, THEIR PREPARATION AND USE AS CATALYSTS UNIVERSITA' DEGLI STUDI DI UDINE (IT) 2005-11-10 WO claimed
US-6005148-A COMPRISING SUPPORT, ANCHORING AGENT SUCH AS HETEROPOLY ACID OR ANION, AND METAL COMPLEX USEFUL IN HYDROGENATION OF SUBSTITUTED UNSATURATED ACIDS AND ESTERS SETON HALL UNIVERSITY (US) 1999-12-21 US claimed
EP-0631571-B1 PREPARATION OF OPTICALLY ACTIVE HYDRAZINES AND AMINES DU PONT (US) 1997-06-04 EP claimed
US-5631397-A MULTISTAGE REACTION USING CATALYTIC HYDROGEN REACTION IN PRESENCE OF METAL PHOSPHOROUS CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 1997-05-20 US claimed
US-5426223-A Hydrogenation of n-acyl hydrazones in presence of catalyst comprising complex pf transition metal bonded to phosphine ligands E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-06-20 US claimed
US-5250731-A Asymmetric hydrogenation of N-acylhydrazones to N-acylhydrazines in presence of chiral phospholane complex E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-10-05 US claimed
WO-1993019040-A1 PREPARATION OF OPTICALLY ACTIVE HYDRAZINES AND AMINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-09-30 WO claimed
US-4654176-A Sulphonated chiral phosphines, their preparation and their use RHONE-POULENC SANTE (FR) 1987-03-31 US claimed

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-20250074854-A1 PROCESS FOR THE SELECTIVE CATALYTIC HYDROGENATION OF DIENONES PRDX5, DHX15, NDUFS5 TDP1 2252/4885CYP3A4 49/4885ESR1 3649/4885
US-11390585-B2 Quaternary heteroatom containing compounds SDHA, NQO1, SDHB TDP1 4001/4885CYP3A4 57/4885ESR1 1393/4885

“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.