SCHEMBL18665805

SCHEMBL18665805

Oc1c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc2ccccc2c1-c1c(O)c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 4/20 0.49
▸ CYP11B2 P19099 4/20 0.49
▸ P2RX1 P51575 1/20 0.43
▸ P2RX3 P56373 1/20 0.43
▸ P2RX4 Q99571 1/20 0.43
▸ P2RX7 Q99572 1/20 0.43
▸ CNR1 P21554 1/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ NQO1 P15559 1/20 0.40
▸ ALOX5 P09917 1/20 0.39
▸ PTPN1 P18031 1/20 0.38
▸ GPR84 Q9NQS5 5/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ ERN1 O75460 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MPI P34949 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
SCHEMBL29510228 1.00 CYP11B1 (0.49) CYP11B1CYP11B2P2RX1P2RX3P2RX4
SCHEMBL22229677 0.97 CYP11B1 (0.47) CYP11B1CYP11B2P2RX1P2RX3P2RX4
SCHEMBL30364453 0.97 CYP11B1 (0.47) CYP11B1CYP11B2P2RX1P2RX3P2RX4
Phosphoric Acid SCHEMBL18641129 0.93 CYP11B1 (0.47) CYP11B1CYP11B2P2RX1P2RX3P2RX4
SCHEMBL18912212 0.92 CYP11B1 (0.44) CYP11B1CYP11B2P2RX1P2RX3P2RX4
SCHEMBL29805436 0.90 CYP11B1 (0.45) CYP11B1CYP11B2P2RX1P2RX3P2RX4
SCHEMBL3923123 0.90 CYP11B1 (0.45) CYP11B1CYP11B2P2RX1P2RX3P2RX4
SCHEMBL18912084 0.85 CYP11B1 (0.40) CYP11B1CYP11B2P2RX1P2RX3P2RX4
SCHEMBL22229788 0.84 GPR84 (0.48) CYP11B1CYP11B2NQO1ALOX5GPR84
SCHEMBL18665816 0.84 CYP11B1 (0.41) CYP11B1CYP11B2P2RX1P2RX3P2RX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12534484-B2 Process for preparing dimeric phosphazene derived BrØnsted acids STUDIENGESELLSCHAFT KOHLE GGMBH (DE) 2026-01-27 — — US disclosed
WO-2023249106-A1 THERAPEUTIC AGENT OR PROPHYLACTIC AGENT FOR AMYOTROPHIC LATERAL SCLEROSIS 東レ株式会社 2023-12-28 — — WO disclosed
WO-2023249105-A1 THERAPEUTIC AGENT OR PREVENTIVE AGENT FOR DRUG-INDUCED MYOCARDIAL DISORDERS 東レ株式会社 2023-12-28 — — WO disclosed
WO-2023249107-A1 THERAPEUTIC AGENT OR PROPHYLACTIC AGENT FOR PERIPHERAL NERVE DISORDER 東レ株式会社 2023-12-28 — — WO disclosed
US-20230406870-A1 PROCESS FOR PREPARING DIMERIC PHOSPHAZENE DERIVED BRØNSTED ACIDS STUDIENGESELLSCHAFT KOHLE GGMBH (DE) 2023-12-21 — — US disclosed
EP-4269392-A1 TETRAHYDROQUINOLINE DERIVATIVE AND MEDICINAL USE THEREOF Toray Industries, Inc. (JP) 2023-11-01 — — EP disclosed
CN-116348435-A Process for preparing dimeric phosphazene-derived bronsted acids 科勒研究非盈利有限责任公司 2023-06-27 — — CN disclosed
EP-3599234-B1 STEREOSELECTIVE PROCESS BOEHRINGER INGELHEIM INT (DE) 2021-04-07 — — EP disclosed
US-10626099-B2 Process for preparing pleuromutilin CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2020-04-21 — — US disclosed
EP-3599234-A1 STEREOSELECTIVE PROCESS Boehringer Ingelheim International GmbH (DE) 2020-01-29 — — EP disclosed
EP-3599234-A1 STEREOSELECTIVE PROCESS Boehringer Ingelheim International GmbH (DE) 2020-01-29 — — EP disclosed
US-10392353-B2 Processes for making substituted quinazoline compounds using hydrogen bonding catalysts MERCK SHARP & DOHME CORP. (US) 2019-08-27 — — US disclosed
US-20190106400-A1 Process For Preparing Pleuromutilin CALIFORNIA INSTITUTE OF TECHNOLOGY 2019-04-11 — — US disclosed
US-10189776-B2 Stereoselective process BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2019-01-29 — — US disclosed
US-10189776-B2 Stereoselective process BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2019-01-29 — — US disclosed
US-20180258031-A1 STEREOSELECTIVE PROCESS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-09-13 — — US disclosed
WO-2017091453-A1 NOVEL PROCESSES FOR MAKING SUBSTITUTED QUINAZOLINE COMPOUNDS USING HYDROGEN BONDING CATALYSTS MERCK SHARP & DOHME CORP. (US) 2017-06-01 — — WO disclosed
WO-2017046355-A1 STEREOSELECTIVE PROCESS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-03-23 — — 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 (7 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-20190106400-A1 Process For Preparing Pleuromutilin PLEC, MLN, MRPL21 CYP11B1 2664/4885CYP11B2 2373/4885P2RX1 876/4885
US-10626099-B2 Process for preparing pleuromutilin PLEC, MLN, MRPL21 CYP11B1 2664/4885CYP11B2 2373/4885P2RX1 876/4885
US-20230406870-A1 PROCESS FOR PREPARING DIMERIC PHOSPHAZENE DERIVED BRØNSTED ACIDS PHOSPHO1, BRPF1, BRD9 CYP11B1 3165/4885CYP11B2 3450/4885P2RX1 644/4885
US-10189776-B2 Stereoselective process CYP4A11, CYP4B1, CYP3A4 CYP11B1 9/4885CYP11B2 10/4885P2RX1 1729/4885
US-12534484-B2 Process for preparing dimeric phosphazene derived BrØnsted acids HAT1, LBR, CD79B CYP11B1 487/4885CYP11B2 608/4885P2RX1 3712/4885
US-20180258031-A1 STEREOSELECTIVE PROCESS CYP4A11, CYP4B1, CYP3A4 CYP11B1 9/4885CYP11B2 10/4885P2RX1 1729/4885
US-10392353-B2 Processes for making substituted quinazoline compounds using hydrogen bonding catalysts NQO1, NDUFS7, NDUFS2 CYP11B1 342/4885CYP11B2 207/4885P2RX1 3396/4885

“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.

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