SCHEMBL6743318

SCHEMBL6743318

C1=CC(=C(c2ccccc2)c2ccccc2)C=C1C1C2CC3CC(C2)CC1C3

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.35
USP2 O75604 1/20 0.35
EPHX2 P34913 3/20 0.32
SIGMAR1 Q99720 1/20 0.31
FAAH O00519 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
SCHEMBL6740489 0.75
SCHEMBL18335695 0.73 KMT2A (0.34) KMT2AUSP2EPHX2SIGMAR1
SCHEMBL28731873 0.64 MAPT (0.47) KMT2AUSP2
SCHEMBL3308965 0.63 MAOB (0.41) EPHX2
SCHEMBL5086744 0.63 MEN1 (0.41) KMT2A
Benzoic Acid SCHEMBL29142624 0.62 TSHR (0.44) KMT2AUSP2EPHX2FAAH
SCHEMBL9721529 0.61 HTR2C (0.42) SIGMAR1
SCHEMBL28223258 0.60 ALDH1A1 (0.45) KMT2AUSP2EPHX2
SCHEMBL5313659 0.60 KMT2A (0.49) KMT2AUSP2EPHX2FAAH
Adamantane SCHEMBL163246 0.59 TSHR (0.70) KMT2AUSP2FAAH

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
US-6693153-B2 USING COORDINATION CATALYST CALIFORNIA INSTITUTE OF TECHNOLOGY 2004-02-17 US disclosed
US-20030139544-A1 Catalyst system for the polymerization of alkenes to polyolefins ENERGY, UNITED STATES DEPARTMENT OF 2003-07-24 US disclosed
US-6469188-B1 CATALYST SYSTEMS PARTICULARLY USEFUL FOR THE POLYMERIZATION OF POLYPROPYLENE TO GIVE ELASTOMERIC POLYPROPYLENES CALIFORNIA INSTITUTE OF TECHNOLOGY 2002-10-22 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-20030139544-A1 Catalyst system for the polymerization of alkenes to polyolefins MSH2, PMS2, SDC4 KMT2A 2729/4885USP2 1605/4885EPHX2 2339/4885

“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.