SCHEMBL7130876

SCHEMBL7130876

c1ccc2c(c1)-c1[nH]c3ccccc3c1C2CCC1c2ccccc2-c2[nH]c3ccccc3c21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
GPR3 P46089 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
HTR2A P28223 3/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
MAPT P10636 3/20 0.36
KCNH2 Q12809 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HTR2C P28335 1/20 0.36
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35
LMNA P02545 2/20 0.35
ALOX15 P16050 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SIGMAR1 Q99720 2/20 0.35

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
SCHEMBL7126918 0.90 ALDH1A1 (0.39) ALDH1A1GPR3HSD17B10CA1CA2
SCHEMBL7733259 0.77 MEN1 (0.44) ALDH1A1GPR3HSD17B10CA1CA2
Hydrochloric Acid SCHEMBL8578558 0.76 ALDH1A1 (0.39) ALDH1A1GPR3HSD17B10CA1CA2
SCHEMBL28462416 0.75 PLAU (0.41) ALDH1A1GPR3HSD17B10CA1CA2
SCHEMBL7124721 0.75 ALDH1A1 (0.38) ALDH1A1GPR3HSD17B10CA1CA2
SCHEMBL7127330 0.73 KDM4E (0.38) ALDH1A1GPR3HSD17B10CA1CA2
SCHEMBL7124333 0.73 MEN1 (0.41) ALDH1A1GPR3HSD17B10CA1CA2
SCHEMBL7124734 0.68 ALDH1A1 (0.38) ALDH1A1GPR3HSD17B10CA1CA2
SCHEMBL5353138 0.68 HTR2A (0.64) GPR3HSD17B10CA1CA2HTR2A
Hydrochloric Acid SCHEMBL6557729 0.64 HTR2A (0.58) GPR3HSD17B10CA1CA2HTR2A

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-20030148877-A1 Metallocenes and catalysts for olefin-polymerisation BASELL TECHNOLOGY COMPANY BV (NL) 2003-08-07 US disclosed
EP-0952978-B1 METALLOCENES AND CATALYSTS FOR OLEFIN-POLYMERISATION BASELL POLYOLEFINE GMBH (DE) 2003-01-22 EP disclosed
US-6451724-B1 BIS(N-METHYL-5,10-DIHYDROINDENO(1,2-B)INDOL-10 -YL)TITANIUM DICHLORIDE BASELL TECHNOLOGY COMPANY BV (NL) 2002-09-17 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-20030148877-A1 Metallocenes and catalysts for olefin-polymerisation MT-CO1, CPNE4, MT-CO3 ALDH1A1 2373/4885GPR3 3696/4885HSD17B10 3735/4885

“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.