SCHEMBL16458362

SCHEMBL16458362

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

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 11/20 0.34
IDH1 O75874 2/20 0.33
POLB P06746 2/20 0.31
LMNA P02545 1/20 0.31
CALM1 P0DP23 1/20 0.31

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
SCHEMBL12814642 0.89 CYP3A4 (0.37) TACR1LMNA
SCHEMBL12814742 0.85 CALM1 (0.37) CALM1
SCHEMBL6255340 0.77 CALM1 (0.38) IDH1CALM1
SCHEMBL12815792 0.76
SCHEMBL12814619 0.75 TP53 (0.31)
SCHEMBL12815363 0.74 NOS2 (0.31)
SCHEMBL27933498 0.73 SLC6A2 (0.42) CALM1
SCHEMBL16458745 0.72 IDH1 (0.33) TACR1IDH1POLBLMNACALM1
SCHEMBL12815424 0.71
SCHEMBL6251956 0.71 CALM1 (0.42) POLBLMNACALM1

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 TACR1 4006/4885IDH1 1954/4885POLB 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.