SCHEMBL8644693

SCHEMBL8644693

C#Cc1ccc2c(c1)N(c1ncnc3cc(OC)c(OC)cc13)CC2

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.69
CSF1R P07333 1/20 0.68
RET P07949 2/20 0.56
KIF5B P33176 1/20 0.56
KDR P35968 1/20 0.56
KIT P10721 2/20 0.52
ACHE P22303 6/20 0.50
BACE1 P56817 6/20 0.50
PDE10A Q9Y233 3/20 0.46
GAK O14976 1/20 0.46
ALDH1A1 P00352 1/20 0.46
FBP1 P09467 1/20 0.46
MAPT P10636 1/20 0.46
PDE3B Q13370 2/20 0.44
PDE3A Q14432 2/20 0.44
ILK Q13418 1/20 0.44

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
SCHEMBL8649204 0.88 EGFR (0.67) EGFRCSF1RRETKIF5BKDR
SCHEMBL9053074 0.84 EGFR (0.75) EGFRCSF1RRETKIF5BKDR
SCHEMBL9052748 0.84 EGFR (0.75) EGFRCSF1RRETKIF5BKDR
SCHEMBL8644637 0.84 EGFR (0.75) EGFRCSF1RRETKIF5BKDR
Hydrochloric Acid SCHEMBL8647412 0.84 EGFR (0.76) EGFRCSF1RRETKIF5BKDR
SCHEMBL9057163 0.84 EGFR (0.73) EGFRCSF1RRETKIF5BKDR
SCHEMBL8650196 0.84 EGFR (0.73) EGFRCSF1RRETKIF5BKDR
SCHEMBL8649000 0.84 EGFR (0.73) EGFRCSF1RRETKIF5BKDR
SCHEMBL9056703 0.84 EGFR (0.73) EGFRCSF1RRETKIF5BKDR
Hydrochloric Acid SCHEMBL8649141 0.84 EGFR (0.76) EGFRCSF1RRETKIF5BKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5736534-A HYPERPROLIFERATIVE DISEASES; INHIBITORS OF PROTEIN-TYROSINE KINASES SUCH AS EPIDERMAL GROWTH FACTOR RECEPTOR; BRAIN, LUNG, BREAST CANCER; PSORIASIS AND BENIGN PROSTATE HYPERPLASIA PFIZER INC. (US) 1998-04-07 US disclosed
WO-1995023141-A1 4-HETEROCYCLYL-SUBSTITUTED QUINAZOLINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS ANTI-CANCER AGENTS PFIZER INC. (US) 1995-08-31 WO disclosed