SCHEMBL7975892

SCHEMBL7975892

CC(C)Oc1ccc2c(c1)ncn2-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 16/20 1.00
KDR P35968 1/20 0.63
SRC P12931 4/20 0.62

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
Hydrochloric Acid SCHEMBL7987501 0.99 FGFR1 (0.97) FGFR1KDRSRC
SCHEMBL20603962 0.86 FGFR1 (0.75) FGFR1KDRSRC
SCHEMBL8006768 0.85 FGFR1 (1.00) FGFR1KDRSRC
SCHEMBL7990502 0.85 FGFR1 (0.73) FGFR1KDRSRC
Hydrochloric Acid SCHEMBL7989899 0.84 FGFR1 (0.97) FGFR1KDRSRC
SCHEMBL7986395 0.82 FGFR1 (0.80) FGFR1KDRSRC
Hydrochloric Acid SCHEMBL7975633 0.81 FGFR1 (0.78) FGFR1KDRSRC
SCHEMBL7993339 0.80 FGFR1 (1.00) FGFR1KDRSRC
SCHEMBL7992992 0.80 FGFR1 (1.00) FGFR1KDRSRC
SCHEMBL15213070 0.80 FGFR1 (0.67) FGFR1KDRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6218388-B1 THERAPY OF PROTEIN TYROSINE KINASE MEDIATED CANCER, ATHEROSCLEROSIS, RESTENOSIS, AND PSORIASIS BY ADMINISTERING BENZIMIDAZOLE DERIVATIVE WARNER-LAMBERT COMPANY 2001-04-17 US disclosed
US-6207686-B1 FOR THERAPY OF HYPERTENSION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-03-27 US disclosed
US-5990146-A TREATING PROTEIN TYROSINE KINASE MEDIATED CANCER; ANTICARCINOGENIC AGENTS; ATHEROSCLEROSIS; RESTENOSIS; PSORIASIS; ANTIPROLIFERATIVE AGENTS WARNER-LAMBERT COMPANY (US) 1999-11-23 US disclosed
WO-1996015109-A1 ENDOTHELIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-23 WO disclosed