SCHEMBL290497

SCHEMBL290497

C1=Cc2cccc3c2c(cc2ccccc23)N1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
HSD17B10 Q99714 5/20 0.42
CYP1A2 P05177 3/20 0.42
HPGD P15428 3/20 0.42
HIF1A Q16665 2/20 0.42
TSHR P16473 2/20 0.42
ERBB2 P04626 1/20 0.42
FYN P06241 1/20 0.42
MAOA P21397 1/20 0.42
ACHE P22303 1/20 0.42
AHR P35869 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP1 P29466 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP1B1 Q16678 1/20 0.36
THRB P10828 1/20 0.36
TRPM4 Q8TD43 1/20 0.33
CYP2A6 P11509 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HPRT1 P00492 1/20 0.30

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
SCHEMBL31280686 0.86 ALDH1A1 (0.42) ALDH1A1HSD17B10CYP1A2HPGDHIF1A
SCHEMBL5702406 0.76 CYP1A2 (0.42) ALDH1A1HSD17B10CYP1A2HPGDHIF1A
SCHEMBL20957573 0.75 PTPN22 (0.35) ALDH1A1HSD17B10HPGDTSHRCASP1
SCHEMBL29413773 0.74 GRK6 (0.42) ALDH1A1HSD17B10CYP1A2HPGDTSHR
SCHEMBL29988480 0.74 GRK6 (0.42) ALDH1A1HSD17B10CYP1A2HPGDTSHR
SCHEMBL8113 0.74 GRK6 (0.42) ALDH1A1HSD17B10CYP1A2HPGDTSHR
SCHEMBL25508 0.74 ALDH1A1 (0.50) ALDH1A1HSD17B10CYP1A2HPGDHIF1A
SCHEMBL30879493 0.74 ALDH1A1 (0.50) ALDH1A1HSD17B10CYP1A2HPGDHIF1A
SCHEMBL10615759 0.72 MPO (0.38) ALDH1A1HSD17B10HIF1ACASP1TDP1
Hydrochloric Acid SCHEMBL11423023 0.72 GRK6 (0.41) ALDH1A1HSD17B10CYP1A2HPGDTSHR

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4461895-A FOR COMBATTING COLDS AND ALLERGIES WARNER-LAMBERT COMPANY (US) 1984-07-24 US claimed
US-20230141988-A1 PHARMACEUTICAL COMPOSITION FOR USE IN THE TREATMENT OF NEUROLOGICAL DISEASES ACLIPSE ONE INC. 2023-05-11 US disclosed
EP-2640395-A2 TREATMENT OF ADDICTION AND IMPULSE-CONTROL DISORDERS USING PDE7 INHIBITORS Omeros Corporation (US) 2013-09-25 EP disclosed
WO-2012064667-A2 TREATMENT OF ADDICTION AND IMPULSE-CONTROL DISORDERS USING PDE7 INHIBITORS OMEROS CORPORATION (US) 2012-05-18 WO disclosed
EP-2427193-A1 USE OF PDE7 INHIBITORS FOR THE TREATMENT OF MOVEMENT DISORDERS Omeros Corporation (US) 2012-03-14 EP disclosed
WO-2010129036-A1 USE OF PDE7 INHIBITORS FOR THE TREATMENT OF MOVEMENT DISORDERS OMEROS CORPORATION (US) 2010-11-11 WO disclosed
US-4461895-A FOR COMBATTING COLDS AND ALLERGIES WARNER-LAMBERT COMPANY (US) 1984-07-24 US disclosed
US-4461895-A FOR COMBATTING COLDS AND ALLERGIES WARNER-LAMBERT COMPANY (US) 1984-07-24 US disclosed
US-4461895-A FOR COMBATTING COLDS AND ALLERGIES WARNER-LAMBERT COMPANY (US) 1984-07-24 US disclosed
EP-0064685-A1 Dibenzo(de,g)quinolines, processes for their preparation and pharmaceutical preparations containing them GÖDECKE AKTIENGESELLSCHAFT (DE) 1982-11-17 EP 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 (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-20230141988-A1 PHARMACEUTICAL COMPOSITION FOR USE IN THE TREATMENT OF NEUROLOGICAL DISEASES PARK7, SNCA, ATXN10 ALDH1A1 573/4885HSD17B10 606/4885CYP1A2 411/4885

“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.