SCHEMBL88611

SCHEMBL88611

c1cnc2nccnc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.55
MAPT P10636 5/20 0.50
KDM4E B2RXH2 4/20 0.50
POLB P06746 3/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
CYP3A4 P08684 2/20 0.39
USP2 O75604 1/20 0.39
BCHE P06276 2/20 0.39
ACHE P22303 2/20 0.39
HTT P42858 4/20 0.38
LMNA P02545 3/20 0.38
HSP90AA1 P07900 3/20 0.38
CASP1 P29466 2/20 0.38
HSP90AB1 P08238 2/20 0.38
HIF1A Q16665 2/20 0.38
TP53 P04637 2/20 0.38
TSHR P16473 2/20 0.38

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
SCHEMBL29408294 1.00 ALDH1A1 (0.55) ALDH1A1MAPTKDM4EPOLBNPC1
SCHEMBL29358342 1.00 ALDH1A1 (0.55) ALDH1A1MAPTKDM4EPOLBNPC1
Ethyne SCHEMBL27784530 0.95 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EPOLBNPC1
Biphenyl SCHEMBL27984062 0.88 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EPOLBNPC1
Furan SCHEMBL29037471 0.86 ALDH1A1 (0.43) ALDH1A1MAPTKDM4EPOLBNPC1
Piperazine SCHEMBL28097858 0.86 ALDH1A1 (0.43) ALDH1A1MAPTKDM4ECYP3A4LMNA
Phthalazine SCHEMBL11491846 0.82 ALDH1A1 (0.56) ALDH1A1MAPTKDM4EPOLBNPC1
SCHEMBL14856779 0.82 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EPOLBNPC1
SCHEMBL8194 0.81 ALDH1A1 (0.67) ALDH1A1MAPTKDM4EPOLBNPC1
SCHEMBL30099834 0.81 ALDH1A1 (0.67) ALDH1A1MAPTKDM4EPOLBNPC1

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

Appears in 4765 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4396191-B1 COMPOUNDS USEFUL IN MODULATION OF AHR SIGNALLING JAGUAHR THERAPEUTICS PTE LTD (SG) 2026-02-18 EP claimed
US-20250388599-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2025-12-25 US claimed
US-12402525-B2 Heterocyclic compound, light-emitting device including the same, and electronic apparatus including the light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2025-08-26 US claimed
US-12310233-B2 Development of material for hole blocking layer with high efficiency and long lifespan, and organic light-emitting device and electronic apparatus utilizing the same SAMSUNG DISPLAY CO., LTD. (KR) 2025-05-20 US claimed
WO-2025076059-A1 ROCAGLATE DERIVATIVES AND USES THEREOF TRUSTEES OF BOSTON UNIVERSITY (US) 2025-04-10 WO claimed
CN-119700771-A Use of pyridopyrazine derivatives for the preparation of medicaments for the treatment of leukemia 中山大学肿瘤防治中心(中山大学附属肿瘤医院、中山大学肿瘤研究所) 2025-03-28 CN claimed
CN-119707864-A Compound, luminescent layer main body material and organic electroluminescent device 北京师范大学 2025-03-28 CN claimed
CN-119661537-A Nucleoside compound, preparation method thereof, composition thereof and application of nucleoside compound in medicine 中国科学院上海药物研究所 2025-03-21 CN claimed
US-20240415819-A1 MACROCYCLIC COMPOUNDS AS PROTEASOME SUBUNIT BETA TYPE-5 INHIBITORS QLi5 Therapeutics AG (DE) 2024-12-19 US claimed
CN-118955362-A Polysubstituted pyridine derivative compound and application thereof 烟台显华科技集团股份有限公司 2024-11-15 CN claimed
EP-0004872-B1 SOLUTION FOR THE ETCHING OF SILICON WAFERS HAVING A WELL-DEFINED ETCHING RATE AND METHOD RESULTING THEREFROM International Business Machines Corporation (US) 1981-10-28 EP claimed
US-4229308-A HOMOPOLYMERS OF CONJUGATED DIENES OR COPOLYMERS WITH A VINYL AROMATIC COMPOUND RHONE-POULENC INDUSTRIES (FR) 1980-10-21 US claimed
US-4226863-A BACTERICIDES, ANTIBIOTICS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-10-07 US claimed
EP-0009677-A1 Quaternary solution for the chemical etching of silicon and method for etching using such a solution International Business Machines Corporation (US) 1980-04-16 EP claimed
US-4187140-A ETHYLENEDIAMINE, PYROCATECHOL AND A DIAZINE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1980-02-05 US claimed
EP-0004872-A2 Solution for the etching of silicon wafers having a well-defined etching rate and method resulting therefrom International Business Machines Corporation (US) 1979-10-31 EP claimed
US-4160087-A BACTERICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-07-03 US claimed
US-4156724-A N-acylamino-alpha-arylacetamido cephalosporins and antibacterial compositions and methods containing them SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-05-29 US claimed
US-4155866-A Method of controlling silicon wafer etching rates-utilizing a diazine catalyzed etchant INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1979-05-22 US claimed
US-4125611-A MICROBIOCIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1978-11-14 US claimed