SCHEMBL16459334

SCHEMBL16459334

Cc1cc(C)cc(C(C2=C(Cc3ccccc3)C=CC2)(c2cc(C)cc(C)c2)c2cc(C)cc(C)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 2/20 0.36
CALM1 P0DP23 1/20 0.31
LMNA P02545 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSPO P30536 1/20 0.31
TACR1 P25103 2/20 0.30
HTR2C P28335 1/20 0.30

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
SCHEMBL12815231 0.89 KIF11 (0.38) IDH1CYP2D6
SCHEMBL12814523 0.86 CALM1 (0.37) CALM1
SCHEMBL12814952 0.80
SCHEMBL6851032 0.78 KIF11 (0.36) CYP2D6
SCHEMBL6055283 0.78 KIF11 (0.36) CYP2D6
SCHEMBL16459121 0.77
SCHEMBL12816579 0.77 CALM1 (0.34) CALM1LMNACYP2D6
SCHEMBL12815464 0.76
SCHEMBL16459481 0.75 NOS2 (0.31)
SCHEMBL12814762 0.75 CALM1 (0.32) CALM1LMNACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140012056-A1 METHOD FOR PRODUCING 1-HEXENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-09 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-20140012056-A1 METHOD FOR PRODUCING 1-HEXENE AP2A1, AP1M1, ME1 IDH1 1954/4885CALM1 1570/4885LMNA 3551/4885

“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.