SCHEMBL115599

SCHEMBL115599

Clc1ncnc2c1ncn2C1CCCCO1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.68
PI4KA P42356 4/20 0.65
PI4K2B Q8TCG2 4/20 0.65
PI4K2A Q9BTU6 4/20 0.65
PI4KB Q9UBF8 4/20 0.65
MEN1 O00255 2/20 0.65
ALDH1A1 P00352 2/20 0.65
KMT2A Q03164 2/20 0.65
TP53 P04637 1/20 0.65
CYP2C9 P11712 1/20 0.65
NFKB1 P19838 1/20 0.65
MAPK1 P28482 1/20 0.65
HSD17B10 Q99714 1/20 0.65
APEX1 P27695 1/20 0.65
BLM P54132 1/20 0.65
ADCY1 Q08828 1/20 0.65
CYP1A2 P05177 2/20 0.64
TSHR P16473 1/20 0.64
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57

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
SCHEMBL29683060 1.00 CYP2C19 (0.68) CYP2C19PI4KAPI4K2BPI4K2API4KB
Methane SCHEMBL10552077 0.99 CYP2C19 (0.67) CYP2C19PI4KAPI4K2BPI4K2API4KB
SCHEMBL1998927 0.96 PI4KA (0.71) CYP2C19PI4KAPI4K2BPI4K2API4KB
Methane SCHEMBL10551641 0.94 PI4KA (0.69) CYP2C19PI4KAPI4K2BPI4K2API4KB
Ether SCHEMBL10547204 0.91 CYP2C19 (0.61) CYP2C19PI4KAPI4K2BPI4K2API4KB
SCHEMBL4572213 0.84 CYP2C19 (0.74) CYP2C19PI4KAPI4K2BPI4K2API4KB
SCHEMBL31569297 0.84 CYP2C19 (0.74) CYP2C19PI4KAPI4K2BPI4K2API4KB
SCHEMBL3643112 0.84 CYP2C19 (0.56) CYP2C19PI4KAPI4K2BPI4K2API4KB
SCHEMBL1324553 0.83 CYP2C19 (0.72) CYP2C19PI4KAPI4K2BPI4K2API4KB
SCHEMBL219612 0.83 CYP2C19 (0.68) CYP2C19PI4KAPI4K2BPI4K2API4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160244452-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INFINITY PHARMACEUTICALS INC (US) 2016-08-25 US claimed
WO-2015061204-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INFINITY PHARMACEUTICALS, INC. (US) 2015-04-30 WO claimed
US-20260117148-A1 SEMICONDUCTOR TREATMENT LIQUID, TREATMENT METHOD FOR OBJECT TO BE TREATED, AND MANUFACTURING METHOD OF ELECTRONIC DEVICE FUJIFILM CORP (JP) 2026-04-30 US disclosed
US-20260042780-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE LLC (US) 2026-02-12 US disclosed
US-20250353857-A1 COMPOUND ACTIVE AS INHIBITOR OF COLONY STIMULATION FACTOR-1 RECEPTOR (CSF-1 R) NORWEGIAN UNIVERSITY OF SCIENCE AND TECHNOLOGY (NTNU) (NO) 2025-11-20 US disclosed
US-20250340565-A1 CD73 INHIBITOR COMPOUNDS ADORX THERAPEUTICS LTD (GB) 2025-11-06 US disclosed
US-20250320430-A1 SEMICONDUCTOR TREATMENT LIQUID, TREATMENT METHOD FOR OBJECT TO BE TREATED, AND MANUFACTURING METHOD OF ELECTRONIC DEVICE FUJIFILM CORP (JP) 2025-10-16 US disclosed
US-12414954-B2 POLQ inhibitors ASTRAZENECA AB (SE) 2025-09-16 US disclosed
EP-3719018-B1 PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LTD (GB) 2025-08-27 EP disclosed
EP-4594308-A1 N-ACRYLOYLMORPHOLINE DERIVATIVES AS KEAP1 MODULATORS AND USES THEREOF Vividion Therapeutics, Inc. (US) 2025-08-06 EP disclosed
WO-2025134877-A1 KIT AND METHOD FOR MANUFACTURING SEMICONDUCTOR DEVICE FUJIFILM CORPORATION (JP) 2025-06-26 WO disclosed
US-5164390-A Cardiac disorders ORTHO PHARMACEUTICAL CORPORATION (US) 1992-11-17 US disclosed
EP-0458618-A1 6-Substituted purinyl piperazine derivatives ORTHO PHARMACEUTICAL CORPORATION (US) 1991-11-27 EP disclosed
US-5021574-A Cardiotonic agents, antiarrhythmia agents ORTHO PHARMACEUTICAL CORPORATION (US) 1991-06-04 US disclosed
EP-0212535-B1 N6-DISUBSTITUTED PURINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Roche Diagnostics GmbH (DE) 1991-05-29 EP disclosed
US-4876257-A 6-Substituted purinyl piperazine derivatives useful as cardiotonic and antiarrhythmic agents ORTHO PHARMACEUTICAL CORPORATION (US) 1989-10-24 US disclosed
EP-0331511-A1 6-Substituted purinyl piperazine derivatives ORTHO PHARMACEUTICAL CORPORATION (US) 1989-09-06 EP disclosed
US-4853386-A INHIBITORS OF SRS-A(SLOW REACTING SUBSTANCE OF ANAPHYLAXIS) FROM LUNG TISSUES BOEHRINGER MANNHEIM GMBH (DE) 1989-08-01 US disclosed
EP-0212535-A1 N6-disubstituted purine derivatives, process for their preparation and medicaments containing them Roche Diagnostics GmbH (DE) 1987-03-04 EP disclosed
US-4241063-A Purine derivatives and their use as bronchodilators BRISTOL-MYERS COMPANY (US) 1980-12-23 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 (6 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-20160244452-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PIK3CA, PIK3CD, PIK3CB CYP2C19 1354/4885PI4KA 14/4885PI4K2B 32/4885
US-20260117148-A1 SEMICONDUCTOR TREATMENT LIQUID, TREATMENT METHOD FOR OBJECT TO BE TREATED, AND MANUFACTURING METHOD OF ELECTRONIC DEVICE TPMT, P2RY13, TST CYP2C19 1995/4885PI4KA 2806/4885PI4K2B 3216/4885
US-20250340565-A1 CD73 INHIBITOR COMPOUNDS ENTPD5, ENTPD1, NT5E CYP2C19 653/4885PI4KA 2088/4885PI4K2B 2888/4885
US-12414954-B2 POLQ inhibitors POLQ, POLG, POLB CYP2C19 1292/4885PI4KA 409/4885PI4K2B 621/4885
US-20250353857-A1 COMPOUND ACTIVE AS INHIBITOR OF COLONY STIMULATION FACTOR-1 RECEPTOR (CSF-1 R) CSF1R, CSF3R, IL1RN CYP2C19 4612/4885PI4KA 1750/4885PI4K2B 1785/4885
US-20260042780-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS PTEN, PIK3C2A, PIK3CA CYP2C19 845/4885PI4KA 41/4885PI4K2B 42/4885

“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.