SCHEMBL18909797

SCHEMBL18909797

CNNC1CCCCCCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
HSD17B10 Q99714 1/20 0.47
SIGMAR1 Q99720 2/20 0.39
EPHX1 P07099 6/20 0.38
NPC1 O15118 3/20 0.38
CYP3A4 P08684 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CA1 P00915 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH4 P08319 1/20 0.38
CA12 O43570 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
EPHX2 P34913 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
SCHEMBL22906419 1.00 ALDH1A1 (0.47) ALDH1A1HSD17B10SIGMAR1EPHX1NPC1
SCHEMBL1679774 1.00
SCHEMBL20963029 1.00 ALDH1A1 (0.47) ALDH1A1HSD17B10SIGMAR1EPHX1NPC1
SCHEMBL12807926 1.00 ALDH1A1 (0.47) ALDH1A1HSD17B10SIGMAR1EPHX1NPC1
Hydrochloric Acid SCHEMBL7345601 0.97 ALDH1A1 (0.45) ALDH1A1HSD17B10SIGMAR1EPHX1NPC1
SCHEMBL13440487 0.97
SCHEMBL17256488 0.90
Hydrochloric Acid SCHEMBL27988384 0.88
Alcohol SCHEMBL17743422 0.84 EPHX1 (0.35) ALDH1A1HSD17B10SIGMAR1EPHX1SMN1; SMN2
SCHEMBL10667304 0.83

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-9938272-B2 Hydrazine compound as blood coagulation factor Xa inhibitor NORTH CHINA PHARMACEUTICAL COMPANY., LTD. (CN) 2018-04-10 US disclosed
US-20170152259-A1 HYDRAZINE COMPOUND AS BLOOD COAGULATION FACTOR Xa INHIBITOR NORTH CHINA PHARMACEUTICAL COMPANY., LTD. (CN) 2017-06-01 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-20170152259-A1 HYDRAZINE COMPOUND AS BLOOD COAGULATION FACTOR Xa INHIBITOR F12, F10, F11 ALDH1A1 2302/4885HSD17B10 233/4885SIGMAR1 3272/4885

“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.