SCHEMBL2081677

SCHEMBL2081677

Nc1ccc2nc[nH]c(=O)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 8/20 1.00
CHEK1 O14757 1/20 0.64
PIM1 P11309 1/20 0.64
AKT1 P31749 1/20 0.64
FLT3 P36888 1/20 0.64
PIM3 Q86V86 1/20 0.64
IP6K1 Q92551 7/20 0.58
SLC2A1 P11166 1/20 0.57
PDPK1 O15530 1/20 0.56
CA12 O43570 1/20 0.56
ALOX15 P16050 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CA9 Q16790 1/20 0.56
TNKS2 Q9H2K2 1/20 0.56
PRKCI P41743 1/20 0.56
KDM4E B2RXH2 1/20 0.55
MAPT P10636 1/20 0.55
RAD52 P43351 1/20 0.55
IP6K3 Q96PC2 5/20 0.54
IP6K2 Q9UHH9 3/20 0.54

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
SCHEMBL1663771 0.85 PARP1 (0.74) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL4252782 0.82 PARP1 (0.69) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL8622180 0.81 ACVR1 (0.73) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL216176 0.78 PARP1 (1.00) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL29784205 0.78 PARP1 (1.00) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL30110907 0.78 PARP1 (0.64) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL2191067 0.78 PARP1 (1.00) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL29709603 0.78 PARP1 (1.00) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL642178 0.78 PARP1 (1.00) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL29701199 0.78 PARP1 (1.00) PARP1CHEK1PIM1AKT1FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4997920-A Dyeing polyolefins CIBA-GEIGY CORPORATION (US) 1991-03-05 US claimed
US-4670486-A Polymer composition pigmented with copper or nickel complexes of ligands containing a semicarbazone moiety CIBA-GEIGY CORPORATION (US) 1987-06-02 US claimed
EP-4334298-B1 UREA DERIVATIVES WHICH CAN BE USED TO TREAT CANCER SCORPION THERAPEUTICS INC (US) 2026-02-18 EP disclosed
US-20250320184-A1 SARM1 MODULATORS, PREPARATIONS, AND USES THEREOF SIRONAX LTD (KY) 2025-10-16 US disclosed
US-20250250259-A1 METHODS FOR TREATING CANCER SCORPION THERAPEUTICS, INC. 2025-08-07 US disclosed
US-12312341-B2 Methods for treating cancer SCORPION THERAPEUTICS, INC. (US) 2025-05-27 US disclosed
EP-4536640-A1 SARM1 MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2025-04-16 EP disclosed
WO-2025067168-A1 AZA FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2025-04-03 WO disclosed
CN-119731169-A Sodium channel regulator and application thereof 上海汇伦医药股份有限公司 2025-03-28 CN disclosed
EP-4073044-B1 NEW BRAF INHIBITORS AS PARADOX BREAKERS HOFFMANN LA ROCHE (CH) 2025-02-19 EP disclosed
CN-119384412-A SARM1 modulators, their preparation and use 维泰瑞隆有限公司 2025-01-28 CN disclosed
US-4775747-A PIGMENTS FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1988-10-04 US disclosed
US-4762838-A Quinazolin-4(3H)-one derivatives as anticoccidial agents PFIZER INC. (US) 1988-08-09 US disclosed
US-4670486-A Polymer composition pigmented with copper or nickel complexes of ligands containing a semicarbazone moiety CIBA-GEIGY CORPORATION (US) 1987-06-02 US disclosed
US-4639477-A AZO DYES CIBA-GEIGY CORPORATION (US) 1987-01-27 US disclosed
US-4400507-A FOR COLORING POLYMERS, LACQUERS CIBA-GEIGY CORPORATION (US) 1983-08-23 US disclosed
US-4263205-A FOR COLORING POLYMERS, LACQUERS CIBA-GEIGY CORPORATION (US) 1981-04-21 US disclosed
US-4262120-A YELLOW TO ORANGE SHADES OF GOOD FASTNESS CIBA-GEIGY CORPORATION (US) 1981-04-14 US disclosed
US-4220586-A FASTNESS TO LIGHT, OVER-LACQUERING, MIGRATION, WEATHERING, AND HEAT CIBA-GEIGY CORPORATION (US) 1980-09-02 US disclosed
US-4116959-A ISOINDOLINE PIGMENTS CIBA-GEIGY CORPORATION (US) 1978-09-26 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 (3 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-20250320184-A1 SARM1 MODULATORS, PREPARATIONS, AND USES THEREOF SARM1, SMN1; SMN2, ADRM1 PARP1 943/4885CHEK1 2609/4885PIM1 2987/4885
US-12312341-B2 Methods for treating cancer PIK3CA, PTEN, BRCA1 PARP1 1346/4885CHEK1 362/4885PIM1 1874/4885
US-20250250259-A1 METHODS FOR TREATING CANCER PIK3CA, PTEN, BRCA1 PARP1 1346/4885CHEK1 362/4885PIM1 1874/4885

“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.