SCHEMBL349009

SCHEMBL349009

O=c1[nH]ccc2ncccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 8/20 0.55
▸ PDPK1 O15530 1/20 0.55
▸ CA12 O43570 1/20 0.55
▸ ALOX15 P16050 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ CA9 Q16790 1/20 0.55
▸ TNKS2 Q9H2K2 1/20 0.55
▸ KDM4E B2RXH2 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ ACVR1 Q04771 3/20 0.48
▸ LMNA P02545 3/20 0.44
▸ CYP3A4 P08684 2/20 0.44
▸ BLM P54132 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ PARP15 Q460N3 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44

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
SCHEMBL29130935 0.98 PARP1 (0.53) PARP1PDPK1CA12ALOX15SMN1; SMN2
SCHEMBL20653883 0.76 MAPT (0.52) SMN1; SMN2KDM4EMAPTACVR1LMNA
SCHEMBL7377865 0.75 ACVR1 (0.55) PARP1PDPK1CA12ALOX15SMN1; SMN2
SCHEMBL13166527 0.73 MAPT (0.48) PARP1SMN1; SMN2KDM4EMAPTACVR1
SCHEMBL2938806 0.73 PARP1 (0.56) PARP1PDPK1CA12ALOX15SMN1; SMN2
SCHEMBL31082754 0.72 KDM4A (0.42) PARP1PDPK1CA12ALOX15SMN1; SMN2
SCHEMBL17276036 0.72 SMN1; SMN2 (0.49) PARP1SMN1; SMN2KDM4EMAPTACVR1
SCHEMBL13166532 0.72 CYP3A4 (0.47) PARP1KDM4EMAPTACVR1LMNA
SCHEMBL29421129 0.72 PARP1 (0.55) PARP1PDPK1CA12ALOX15SMN1; SMN2
SCHEMBL13859959 0.72 MAPT (0.71) KDM4EMAPTACVR1LMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025024663-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2025-01-30 — — WO claimed
EP-3956320-B1 DIHYDROOROTATE DEHYDROGENASE INHIBITORS JANSSEN BIOTECH INC (US) 2023-11-29 — — EP claimed
US-20230027362-A1 ISOQUINOLINONE DERIVATIVES, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING POLY(ADP-RIBOSE) POLYMERASE-1-RELATED DISEASES, COMPRISING THE SAME AS ACTIVE INGREDIENT DIGMBIO. INC. (KR) 2023-01-26 — — US claimed
EP-3337802-A1 HETEROARYL DERIVATIVES AS PARP INHIBITORS Lupin Limited (IN) 2018-06-27 — — EP claimed
WO-2017029601-A1 HETEROARYL DERIVATIVES AS PARP INHIBITORS LUPIN LIMITED (IN) 2017-02-23 — — WO claimed
US-7750151-B2 Inhibitors of Akt activity MERCK SHARP & DOHME CORP. (US) 2010-07-06 — — US claimed
US-20080280899-A1 Inhibitors of Akt Activity MERCK SHARP & DOHME CORP. 2008-11-13 — — US claimed
EP-1737861-A1 INHIBITORS OF AKT ACTIVITY Merck & Co., Inc. (US) 2007-01-03 — — EP claimed
WO-2005100356-A1 INHIBITORS OF AKT ACTIVITY MERCK & CO., INC. (US) 2005-10-27 — — WO claimed
US-5391554-A Antitumor agent WARNER-LAMBERT COMPANY (US) 1995-02-21 — — US claimed
WO-1994005664-A1 NAPHTHYRIDINES AS POTENTIATORS OF LETHAL EFFECTS OF RADIATION ON TUMOUR CELLS WARNER-LAMBERT COMPANY (US) 1994-03-17 — — WO claimed
US-12581252-B2 Substituted pyrrolo[3,4-b]pyridines as PI3K-α inhibitors RELAY THERAPEUTICS, INC. (US) 2026-03-17 — — US disclosed
US-20250353863-A1 TRICYCLIC SPIROLACTAM COMPOUNDS WITH ANTIMYCOBACTERIAL ACTIVITY INST NAT SANTE RECH MED (FR) 2025-11-20 — — US disclosed
US-12459922-B2 PARP7 inhibitors GILEAD SCIENCES, INC. (US) 2025-11-04 — — US disclosed
US-12448368-B2 Indole compounds as androgen receptor modulators NIDO BIOSCIENCES, INC. (US) 2025-10-21 — — US disclosed
US-20030158195-A1 1,6 naphthyridines useful as inhibitors of SYK kinase BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2003-08-21 — — US disclosed
WO-2003057695-A1 1,6 NAPHTHYRIDINES USEFUL AS INHIBITORS OF SYK KINASE BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2003-07-17 — — WO disclosed
WO-2001091796-A2 METHODS, COMPOUNDS AND COMPOSITIONS FOR TREATING GOUT GUILFORD PHARMACEUTICALS INC. (US) 2001-12-06 — — WO disclosed
US-5391554-A Antitumor agent WARNER-LAMBERT COMPANY (US) 1995-02-21 — — US disclosed
WO-1994005664-A1 NAPHTHYRIDINES AS POTENTIATORS OF LETHAL EFFECTS OF RADIATION ON TUMOUR CELLS WARNER-LAMBERT COMPANY (US) 1994-03-17 — — 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-20080280899-A1 Inhibitors of Akt Activity AKT1, AKT2, AKT3 PARP1 852/4885PDPK1 18/4885CA12 3273/4885
US-12459922-B2 PARP7 inhibitors PARP1, PARP11, PARP2 PARP1 1/4885PDPK1 119/4885CA12 4051/4885
US-12448368-B2 Indole compounds as androgen receptor modulators AR, FSHR, ADRB3 PARP1 1538/4885PDPK1 1305/4885CA12 4442/4885
US-20230027362-A1 ISOQUINOLINONE DERIVATIVES, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING POLY(ADP-RIBOSE) POLYMERASE-1-RELATED DISEASES, COMPRISING THE SAME AS ACTIVE INGREDIENT PARP1, PARP2, PARP11 PARP1 1/4885PDPK1 56/4885CA12 4873/4885
US-20030158195-A1 1,6 naphthyridines useful as inhibitors of SYK kinase SYK, IRAK1, BTK PARP1 1287/4885PDPK1 127/4885CA12 4867/4885
US-12581252-B2 Substituted pyrrolo[3,4-b]pyridines as PI3K-α inhibitors RORB, ROR1, RORA PARP1 2620/4885PDPK1 321/4885CA12 4024/4885
US-20250353863-A1 TRICYCLIC SPIROLACTAM COMPOUNDS WITH ANTIMYCOBACTERIAL ACTIVITY TALDO1, TBCA, TBCD PARP1 2559/4885PDPK1 1248/4885CA12 4692/4885

“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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