SCHEMBL6232495

SCHEMBL6232495

Oc1cccc(Oc2cccc(C(F)(F)F)c2Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.49
EPAS1 Q99814 2/20 0.46
MRGPRX4 Q96LA9 1/20 0.46
AR P10275 3/20 0.41
BRAF P15056 2/20 0.37
P2RX4 Q99571 1/20 0.37
STK39 Q9UEW8 1/20 0.37
P2RX7 Q99572 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
SCHEMBL27983650 0.89 EPAS1 (0.51) EPAS1MRGPRX4ARBRAFP2RX7
SCHEMBL8941555 0.86 AR (0.47) RAB9AMRGPRX4AR
SCHEMBL27888403 0.82 EPAS1 (0.45) EPAS1MRGPRX4ARSTK39P2RX7
SCHEMBL6228507 0.82 EPAS1 (0.46) EPAS1MRGPRX4ARP2RX7
SCHEMBL6230322 0.82 MAPT (0.52) RAB9AEPAS1MRGPRX4ARP2RX7
SCHEMBL27947313 0.80 MRGPRX4 (0.64) RAB9AEPAS1MRGPRX4BRAF
SCHEMBL6230387 0.78 MEN1 (0.57) RAB9AEPAS1AR
SCHEMBL11498163 0.77 EPAS1 (0.51) EPAS1MRGPRX4AR
SCHEMBL27533351 0.77 RAB9A (0.53) RAB9AAR
SCHEMBL27983376 0.77 MRGPRX4 (0.44) EPAS1MRGPRX4ARSTK39P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1334086-B1 PHENOXYPHENYL ALKANE SULFONATES BAYER HEALTHCARE AG (DE) 2005-04-06 EP disclosed
US-20040214886-A1 Phenoxyphenyl alkanesulphonates BAYER AKTIENGESELLSCHAFT (DE) 2004-10-28 US disclosed
US-6756409-B2 FOR THERAPY AND PROPHYLAXIS OF PAIN AND/OR NEURODEGENERATIVE DISORDERS BAYER AKTIENGESELLSCHAFT (DE) 2004-06-29 US disclosed
EP-1334086-A1 PHENOXYPHENYL ALKANE SULFONATES Bayer Aktiengesellschaft (DE) 2003-08-13 EP disclosed
US-20030022934-A1 Phenoxyphenyl alkanesulphonates BAYER AKTIENGESELLSCHAFT (DE) 2003-01-30 US disclosed
WO-2002026702-A1 PHENOXYPHENYL ALKANE SULFONATES BAYER AKTIENGESELLSCHAFT (DE) 2002-04-04 WO 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 (2 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-20030022934-A1 Phenoxyphenyl alkanesulphonates SNCA, CLN6, NLN RAB9A 2935/4885EPAS1 2148/4885MRGPRX4 1773/4885
US-20040214886-A1 Phenoxyphenyl alkanesulphonates SNCA, CLN6, NLN RAB9A 2935/4885EPAS1 2148/4885MRGPRX4 1773/4885

“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.