SCHEMBL20093646

SCHEMBL20093646

CCCCCC(CCCCC)NC1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.42
SIGMAR1 Q99720 3/20 0.42
EPHX2 P34913 3/20 0.41
CYP1A2 P05177 1/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NAAA Q02083 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
SCHEMBL24704673 0.98 SIGMAR1 (0.45) EPHX1SIGMAR1EPHX2CYP1A2KMT2A
SCHEMBL18520254 0.98 SIGMAR1 (0.45) EPHX1SIGMAR1EPHX2CYP1A2KMT2A
SCHEMBL11858592 0.98 SIGMAR1 (0.45) EPHX1SIGMAR1EPHX2CYP1A2KMT2A
SCHEMBL24704621 0.98 SIGMAR1 (0.45) EPHX1SIGMAR1EPHX2CYP1A2KMT2A
SCHEMBL19245329 0.98 SIGMAR1 (0.45) EPHX1SIGMAR1EPHX2CYP1A2KMT2A
SCHEMBL27540335 0.96 EPHX1 (0.40) EPHX1SIGMAR1EPHX2CYP1A2
SCHEMBL20747001 0.96 SIGMAR1 (0.42) EPHX1SIGMAR1EPHX2MEN1KMT2A
SCHEMBL22355901 0.96 SIGMAR1 (0.42) EPHX1SIGMAR1EPHX2MEN1KMT2A
SCHEMBL28747291 0.94 SIGMAR1 (0.42) EPHX1SIGMAR1EPHX2KMT2ANAAA
SCHEMBL11298979 0.94 SIGMAR1 (0.42) EPHX1SIGMAR1EPHX2KMT2ANAAA

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-11352340-B2 Pyridine and pyridimine compounds as PI3K-gamma inhibitors INCYTE CORPORATION (US) 2022-06-07 US disclosed
US-20180111913-A1 SUBSTITUTED BENZOFURAN DERIVATIVES AS NOVEL ANTIMYCOBACTERIAL AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-04-26 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 (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-11352340-B2 Pyridine and pyridimine compounds as PI3K-gamma inhibitors PIK3CG, PIK3CD, PIK3CB EPHX1 3368/4885SIGMAR1 3726/4885EPHX2 4188/4885
US-20180111913-A1 SUBSTITUTED BENZOFURAN DERIVATIVES AS NOVEL ANTIMYCOBACTERIAL AGENTS ACAT1, ACAT2, FNTB EPHX1 3534/4885SIGMAR1 3728/4885EPHX2 3979/4885

“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.