SCHEMBL11287477

SCHEMBL11287477

NC(=O)CCCOc1cccc2[nH]c(=O)ccc12

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 6/20 0.43
ALB P02768 1/20 0.43
BCL2 P10415 1/20 0.43
KDM4E B2RXH2 5/20 0.42
ATM Q13315 1/20 0.42
PDE3B Q13370 3/20 0.40
PDE3A Q14432 3/20 0.40
EGFR P00533 1/20 0.39
SRC P12931 1/20 0.39
SRD5A2 P31213 1/20 0.39
CNR1 P21554 1/20 0.38
P2RY12 Q9H244 1/20 0.38
ALDH1A1 P00352 3/20 0.37
TSHR P16473 2/20 0.37
LMNA P02545 2/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL28033877 0.84 PDE3B (0.44) MCL1ALBBCL2KDM4EATM
SCHEMBL11324130 0.83 CYP1A2 (0.44) MCL1ALBBCL2KDM4EPDE3B
SCHEMBL9213988 0.82 GPR84 (0.41) MCL1ALBBCL2KDM4EATM
SCHEMBL11222527 0.77 KDM4E (0.50) KDM4EATMALDH1A1TSHR
SCHEMBL11219891 0.77 HTR1D (0.52) KDM4EATMALDH1A1TSHRLMNA
Hydrochloric Acid SCHEMBL11858150 0.76 KDM4E (0.49) KDM4EATMALDH1A1TSHR
SCHEMBL11282430 0.76 ALDH1A1 (0.47) KDM4EPDE3BPDE3AALDH1A1TSHR
SCHEMBL11308915 0.76 KMT2A (0.53) MCL1ALBBCL2KDM4EALDH1A1
SCHEMBL11322539 0.76 PDE3B (0.63) KDM4EPDE3BPDE3AP2RY12ALDH1A1
SCHEMBL11319689 0.76 ADRB2 (0.42) MCL1ALBBCL2KDM4EATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4313947-A TREATMENT OF BLOOD DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1982-02-02 US disclosed
US-4216220-A Platelet aggregation inhibiting 2-oxyindoles, their compositions and method of use OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1980-08-05 US disclosed
US-4070470-A BENCYCLOAMIDE DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JA) 1978-01-24 US disclosed