SCHEMBL15413017

SCHEMBL15413017

CC1CCCc2cc3c(cc21)CCCC3

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
KMT2A Q03164 1/20 0.35
HTR2A P28223 4/20 0.35
HTR2C P28335 4/20 0.35
HTR2B P41595 4/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
IGF1R P08069 1/20 0.33
ALOX15 P16050 1/20 0.33
DRD2 P14416 2/20 0.32
MAOA P21397 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
DRD3 P35462 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
DRD4 P21917 1/20 0.32

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
SCHEMBL15412529 0.84 CA1 (0.36) CA1CA2CA4KMT2AHTR2A
SCHEMBL12405937 0.79 MAOA (0.55) HTR2AHTR2CHTR2BIGF1RALOX15
SCHEMBL19803966 0.76 IGF1R (0.39) KMT2AHTR2AHTR2CHTR2BIGF1R
SCHEMBL23817883 0.76 CA1 (0.32) CA1CA2CA4KMT2AHTR2A
SCHEMBL11378501 0.74 UGT2B17 (0.44) KMT2AESR1ESR2IGF1RALOX15
SCHEMBL6902991 0.74 SRD5A1 (0.42) KMT2AHTR2AHTR2CHTR2BESR1
SCHEMBL8900410 0.74 ACHE (0.41) CA1CA2HTR2AHTR2CHTR2B
SCHEMBL11081407 0.74 KDM4C (0.43) HTR2AHTR2CHTR2BESR1ESR2
SCHEMBL5713886 0.74 DRD2 (0.41) HTR2AHTR2CHTR2BESR1ESR2
SCHEMBL10876535 0.74 IGF1R (0.37) HTR2AHTR2CHTR2BIGF1RALOX15

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-9394221-B2 Method for manufacturing benzenetetracarboxylic acid JX NIPPON OIL & ENERGY COMPANY (JP) 2016-07-19 US disclosed
US-20140018569-A1 METHOD FOR MANUFACTURING BENZENETETRACARBOXYLIC ACID JX NIPPON OIL & ENERGY CORPORATION (JP) 2014-01-16 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-20140018569-A1 METHOD FOR MANUFACTURING BENZENETETRACARBOXYLIC ACID HAAO, HAO2, HPD CA1 285/4885CA2 268/4885CA4 181/4885

“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.