SCHEMBL19329642

SCHEMBL19329642

CCCCCCCCCCCCc1cc2cc(C)ccc2n1-c1ccccn1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 2/20 0.39
▸ PPARG P37231 1/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ OXER1 Q8TDS5 7/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ DRD2 P14416 1/20 0.36
▸ DRD4 P21917 1/20 0.36
▸ DRD3 P35462 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL19330015 0.87 OXER1 (0.47) TLR8OXER1KCNH2ALDH1A1KDM4E
SCHEMBL19329633 0.87 OXER1 (0.47) TLR8OXER1KCNH2ALDH1A1KDM4E
SCHEMBL19329879 0.85 PDE10A (0.44) PPARGOXER1KDM4EPOLBMAPT
SCHEMBL19329672 0.84 CYP19A1 (0.38) TSHRHSD17B10
SCHEMBL19329643 0.84 CYP19A1 (0.38) TSHRHSD17B10
SCHEMBL19329739 0.76 OXER1 (0.48) TLR8OXER1KCNH2ALDH1A1KDM4E
SCHEMBL30282852 0.73 TLR8 (0.44) TLR8PPARGPPARAOXER1ALDH1A1
SCHEMBL28394930 0.73 PLAUR (0.48) ALDH1A1KDM4ELMNAPOLBMAPT
SCHEMBL28932571 0.70 DHFR (0.45) TLR8PPARGPPARAOXER1ALDH1A1
SCHEMBL680187 0.70 ALDH1A1 (0.46) ALDH1A1KDM4ELMNAPOLBMAPT

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-10940468-B2 Nickel catalyst, process for preparation and use thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-03-09 — — US disclosed
WO-2017154022-A1 NOVEL NICKEL CATALYST, PROCESS FOR PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-09-14 — — WO 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-10940468-B2 Nickel catalyst, process for preparation and use thereof NISCH, NIT2, C9 TLR8 4662/4885PPARG 4518/4885PPARA 4370/4885

“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.

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