SCHEMBL1999306

SCHEMBL1999306

OCc1cc2ccccc2cn1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
CYP1A2 P05177 1/20 0.48
CYP2A6 P11509 1/20 0.48
PDPK1 O15530 1/20 0.48
ALDH1A1 P00352 1/20 0.47
PLAU P00749 1/20 0.44
NOTUM Q6P988 1/20 0.41
PDE10A Q9Y233 4/20 0.41
NPC1 O15118 2/20 0.40
KDM4C Q9H3R0 1/20 0.40
RAB9A P51151 1/20 0.38
CYSLTR1 Q9Y271 2/20 0.37
GPBAR1 Q8TDU6 1/20 0.37
EGLN1 Q9GZT9 1/20 0.37
HTR3A P46098 1/20 0.37
CCR1 P32246 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
SCHEMBL5659090 0.83 ATM (0.57) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL9597587 0.80 ATM (0.63) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL9598426 0.79 ATM (0.61) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL3823640 0.78 ATM (0.51) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL2908675 0.78 L3MBTL1 (0.51) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL3639574 0.78 PDPK1 (0.54) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL873512 0.78 CYP1A2 (0.54) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL6598600 0.78 ATM (0.51) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL13977557 0.78 ATM (0.51) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL29526856 0.78 ATM (0.51) ATML3MBTL1CYP1A2CYP2A6PDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4785104-A CARDIOVASCULAR DISORDERS, INOTROPIC AGENTS EGIS GYOGYSZERGYAR (HU) 1988-11-15 US claimed
CN-115515956-B Benzimidazole derivative, and preparation method and medical application thereof 深圳信立泰药业股份有限公司 2024-06-25 CN disclosed
CN-115515956-A Benzimidazole derivative and preparation method and medical application thereof 深圳信立泰药业股份有限公司 2022-12-23 CN disclosed
US-20220324803-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS INC (US) 2022-10-13 US disclosed
EP-3983412-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF Teon Therapeutics, Inc. (US) 2022-04-20 EP disclosed
WO-2022068772-A1 BENZIMIDAZOLE DERIVATIVE, AND PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF 深圳信立泰药业股份有限公司 2022-04-07 WO disclosed
WO-2022068772-A1 BENZIMIDAZOLE DERIVATIVE, AND PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF 深圳信立泰药业股份有限公司 2022-04-07 WO disclosed
CN-114206866-A Prostaglandin E2Receptor 4 antagonists and uses thereof 泰昂治疗公司 2022-03-18 CN disclosed
WO-2020251957-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS, INC. (US) 2020-12-17 WO disclosed
WO-2020251957-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS, INC. (US) 2020-12-17 WO disclosed
US-4785104-A CARDIOVASCULAR DISORDERS, INOTROPIC AGENTS EGIS GYOGYSZERGYAR (HU) 1988-11-15 US disclosed
EP-0110372-B1 1-PHENYLISOQUINOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1986-09-10 EP disclosed
US-4547508-A 1-Phenylisoquinoline derivatives, pharmaceutical products containing these compounds and their use HOECHST AKTIENGESELLSCHAFT (DE) 1985-10-15 US disclosed
EP-0110372-A1 1-Phenylisoquinoline derivatives, process for their preparation, pharmaceutical compositions containing these compounds and their use HOECHST AKTIENGESELLSCHAFT (DE) 1984-06-13 EP disclosed
US-4287197-A ALSO USEFUL AS ANALGESICS, ANTIPYRETICS AND ANTIINFLAMMATORY AGENTS RHONE-POULENC INDUSTRIES (FR) 1981-09-01 US disclosed
US-4261992-A ANALGESIC, ANTIINFLAMMATORY, ANTIPYRETIC RHONE POULENC INDUSTRIES (FR) 1981-04-14 US disclosed
US-4261993-A ANALGESIC, ANTIINFLAMMATORY, ANTIPYRETIC RHONE POULENC INDUSTRIES (FR) 1981-04-14 US disclosed
US-4108999-A ANTIULCER AGENTS RHONE-POULENC INDUSTRIES (FR) 1978-08-22 US disclosed
US-4064247-A ANALGESIC, ANTIPYRETIC RHONE-POULENC INDUSTRIES (FR) 1977-12-20 US disclosed
US-3891654-A 6,7 Substituted 3-hydroxymethyl- 1 phenyl, benzyl or phenylethyl substituted isoquinolines ALBERT & ROWLAND 1975-06-24 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-20220324803-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF PTGER4, PTGER1, PTGER2 ATM 4047/4885L3MBTL1 4529/4885CYP1A2 927/4885

“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.