SCHEMBL12814950

SCHEMBL12814950

Cc1cccc(C(c2cccc(C)c2)C2c3ccccc3-c3ccccc32)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.43
ATM Q13315 1/20 0.43
ACP3 P15309 1/20 0.41
EPHX1 P07099 1/20 0.40
ACHE P22303 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ELANE P08246 1/20 0.37
GPR3 P46089 1/20 0.35
AOC3 Q16853 1/20 0.35
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
ADORA2A P29274 1/20 0.34
PPIA P62937 1/20 0.33
USP1 O94782 1/20 0.33
WDR48 Q8TAF3 1/20 0.33

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
Hydrochloric Acid SCHEMBL12815204 0.86 MEN1 (0.36) MEN1KMT2APOLBATMACP3
SCHEMBL12815719 0.85 MEN1 (0.42) MEN1KMT2APOLBATMACHE
Hydrochloric Acid SCHEMBL16458132 0.82 ACP3 (0.35) MEN1KMT2APOLBATMACP3
SCHEMBL12815207 0.81 MEN1 (0.33) MEN1KMT2APOLBATMACP3
SCHEMBL3157929 0.80 MEN1 (0.52) MEN1KMT2APOLBATMACHE
SCHEMBL3157883 0.79 MEN1 (0.43) MEN1KMT2APOLBATMACHE
SCHEMBL12814983 0.77 ACP3 (0.38) ACP3EPHX1ACHEALDH1A1MAPT
SCHEMBL28089718 0.77 POLB (0.50) MEN1KMT2APOLBATMGPR3
SCHEMBL3150007 0.76 IDO1 (0.45) MEN1KMT2AATMACP3TSHR
SCHEMBL15617718 0.75 PPIA (0.46) MEN1KMT2APOLBATMEPHX1

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
EP-2691357-A1 METHOD FOR PRODUCING 1-HEXENE Sumitomo Chemical Company Limited (JP) 2014-02-05 EP disclosed
US-20140012056-A1 METHOD FOR PRODUCING 1-HEXENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-09 US disclosed
WO-2012133937-A1 METHOD FOR PRODUCING 1-HEXENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 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 (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-20140012056-A1 METHOD FOR PRODUCING 1-HEXENE AP2A1, AP1M1, ME1 MEN1 512/4885KMT2A 2582/4885POLB 1051/4885

“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.