SCHEMBL4242828

SCHEMBL4242828

O=C(Nc1ccc(-c2ccccc2)cc1)C1=C(O)C(CC2CCCCC2)NC1=O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.43
LMNA P02545 1/20 0.42
RAB9A P51151 1/20 0.42
EPHX2 P34913 1/20 0.41
EPHX1 P07099 1/20 0.40
ROCK2 O75116 1/20 0.40
DEGS1 O15121 1/20 0.40
PTPN1 P18031 2/20 0.39
KDM1A O60341 1/20 0.39
CCR5 P51681 2/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL13743979 0.91 EPHX2 (0.44) LMNARAB9AEPHX2EPHX1CCR5
SCHEMBL13743972 0.89 CHEK2 (0.40) LMNAEPHX2EPHX1CCR5
SCHEMBL13743720 0.89 NPY5R (0.48) DHODHLMNARAB9AEPHX1MAPT
SCHEMBL13744569 0.88 KMT2A (0.44) LMNAEPHX2CCR5MAPT
SCHEMBL13743459 0.86 DEGS1 (0.50) RAB9ADEGS1MAPT
SCHEMBL13743199 0.82 HPGD (0.44) LMNARAB9AEPHX2MAPT
SCHEMBL13743409 0.81 ALDH1A1 (0.51) LMNARAB9AKDM1AMAPT
SCHEMBL13743971 0.80 CHEK2 (0.44)
SCHEMBL13743378 0.80 CCR5 (0.37) LMNARAB9ACCR5MAPT
SCHEMBL4246718 0.79 TAAR1 (0.42) LMNARAB9ADEGS1PTPN1MAPT

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-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 US disclosed
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 US disclosed
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 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-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE FDPS, UMPS, GGPS1 DHODH 89/4885LMNA 2709/4885RAB9A 2428/4885

“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.