SCHEMBL88615

SCHEMBL88615

c1ccc2nncnc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.41
PI4KA P42356 1/20 0.39
PI4K2B Q8TCG2 1/20 0.39
PI4K2A Q9BTU6 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
GPR3 P46089 1/20 0.39
MAPT P10636 4/20 0.38
ALDH1A1 P00352 4/20 0.38
HPGD P15428 2/20 0.38
GLA P06280 1/20 0.38
ACHE P22303 1/20 0.38
PDPK1 O15530 1/20 0.37
ADORA2A P29274 2/20 0.37
PDE10A Q9Y233 1/20 0.34
TSHR P16473 1/20 0.33
DAPK3 O43293 1/20 0.33

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
SCHEMBL29599774 1.00 EGFR (0.41) EGFRPI4KAPI4K2BPI4K2API4KB
Hydrochloric Acid SCHEMBL29733094 0.97 EGFR (0.39) EGFRPI4KAPI4K2BPI4K2API4KB
Hydrochloric Acid SCHEMBL29733087 0.97 EGFR (0.39) EGFRPI4KAPI4K2BPI4K2API4KB
SCHEMBL1285336 0.70 ALDH1A1 (0.39) EGFRPI4KAPI4K2BPI4K2API4KB
SCHEMBL3831708 0.70
SCHEMBL4937147 0.70 ALDH1A1 (0.39) MAPTALDH1A1ACHETSHRMAPK14
Strinoline SCHEMBL11278670 0.69 GPR3 (0.44) EGFRPI4KAPI4K2BPI4K2API4KB
SCHEMBL3819567 0.69
SCHEMBL8401811 0.69 PIK3CG (0.47) EGFRMAPTALDH1A1MAP4K4DYRK1A
SCHEMBL6028972 0.69 NQO2 (0.43) MAPTALDH1A1MAP4K4PIM1RPS6KA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3634953-B1 COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE PTC THERAPEUTICS INC (US) 2024-01-03 EP claimed
CN-117186155-A Organic electroluminescent material and device 环球展览公司 2023-12-08 CN claimed
CN-116969901-A Preparation method of 1,2,4-benzotriazine derivative 浙江师范大学 2023-10-31 CN claimed
CN-116905240-A Automobile skylight composite fabric and preparation method thereof 金华市华尔汽车饰件有限公司 2023-10-20 CN claimed
CN-114957145-B 1,2,4-benzotriazine derivative and preparation method thereof 浙江师范大学 2023-07-18 CN claimed
CN-114957145-A 1,2,4-benzotriazine derivative and preparation method thereof 浙江师范大学 2022-08-30 CN claimed
US-11285165-B2 Selective high-affinity polydentate ligands and methods of making such LAWRENCE LIVERMORE NATIONAL SECURITY, LLC (US) 2022-03-29 US claimed
EP-3305778-B1 INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2022-01-19 EP claimed
EP-2872161-B1 DIANHYDROGALACTITOL FOR USE IN TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS DEL MAR PHARMACEUTICALS (CA) 2020-12-16 EP claimed
EP-3305778-A1 INHIBITORS OF PLASMA KALLIKREIN Kalvista Pharmaceuticals Limited (GB) 2018-04-11 EP claimed
US-5631253-A FUNGICIDES, INSECTICIDES AND MITICIDES USING METHYLOXIME PHENYLPROPENOIC ACID ZENECA LIMITED (GB) 1997-05-20 US claimed
EP-0145337-B1 ELECTROCHROMIC DEVICES CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1990-08-08 EP claimed
EP-0096723-B1 BATTERIES FABRICATED WITH ELECTROACTIVE POLYMERS CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1988-08-10 EP claimed
EP-0137832-B1 PHARMACEUTICAL COMPOSITIONS OF ANTI-PANCREATIC INFLAMMATORY EFFECT BIOGAL GYOGYSZERGYAR (HU) 1987-08-12 EP claimed
US-4613211-A REVERSE COLOR CHANGING POLYMER FILM AS DISPLAY ELECTRODE CHEVRON RESEARCH COMPANY (US) 1986-09-23 US claimed
US-4579679-A Electroactive polymers CHEVRON RESEARCH COMPANY (US) 1986-04-01 US claimed
EP-0145337-A2 Electrochromic devices CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1985-06-19 EP claimed
EP-0096723-A1 BATTERIES FABRICATED WITH ELECTROACTIVE POLYMERS. CHEVRON RES (US) 1983-12-28 EP claimed
WO-1983002368-A1 BATTERIES FABRICATED WITH ELECTROACTIVE POLYMERS CHEVRON RES (US) 1983-07-07 WO claimed
US-4316022-A Benzo-as-triazine derivatives EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1982-02-16 US claimed

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-11285165-B2 Selective high-affinity polydentate ligands and methods of making such CD44, FCGR3B, FCGR2A EGFR 384/4885PI4KA 3466/4885PI4K2B 3489/4885

“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.