SCHEMBL4154876

SCHEMBL4154876

CCOC(=O)c1ccc(C2=C(c3cc(Cl)ccc3O)CCC2)nc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
MAPT P10636 6/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
RAB9A P51151 2/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 2/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 4/20 0.39
P2RY12 Q9H244 1/20 0.39
HSD17B2 P37059 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL4148470 0.88 PTGER1 (0.43) MAPTKDM4EALDH1A1KMT2AHSD17B2
SCHEMBL6141598 0.86 PDGFRB (0.42) MAPTSMN1; SMN2RAB9ATSHRHSD17B10
SCHEMBL5620105 0.84 PTGER1 (0.49) CA12CA1CA2CA7CA9
SCHEMBL4154698 0.83 P4HA1 (0.45) CA1CA2MAPTKDM4EALDH1A1
SCHEMBL4162657 0.81 KDM4E (0.41) MAPTRAB9ANPC1KDM4EALDH1A1
SCHEMBL4156348 0.81 GABRG2 (0.41) MAPTRAB9ATSHRNPC1KDM4E
SCHEMBL5620218 0.81 CYP2C9 (0.43) CA12CA1CA2CA7CA9
SCHEMBL5620244 0.80 PTGER1 (0.49) MAPTSMN1; SMN2TSHRKDM4EALDH1A1
SCHEMBL4160158 0.80 PTGER1 (0.65) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4922664 0.79 CYP2C9 (0.43) CA12CA1CA2CA7CA9

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-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US 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-20090227591-A1 Cyclopentene compounds C1R, CYP1B1, ADORA2B CA12 1895/4885CA1 2841/4885CA2 3393/4885

“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.