SCHEMBL20810067

SCHEMBL20810067

Cc1cc(C)c(-c2cc(CNC(=O)c3cccnc3Cl)on2)c(C)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ LMNA P02545 3/20 0.55
▸ ALDH1A1 P00352 3/20 0.55
▸ POLB P06746 6/20 0.47
▸ MAPT P10636 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ HTT P42858 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ EGFR P00533 1/20 0.42
▸ RAB9A P51151 1/20 0.40
▸ APEX1 P27695 1/20 0.39

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
SCHEMBL20810063 0.86 SMN1; SMN2 (0.56) HPGDSMN1; SMN2LMNAALDH1A1POLB
SCHEMBL20810283 0.84 POLB (0.43) HPGDSMN1; SMN2LMNAALDH1A1POLB
SCHEMBL20810071 0.83 SMN1; SMN2 (0.59) HPGDSMN1; SMN2LMNAALDH1A1POLB
SCHEMBL20810209 0.82 POLB (0.62) HPGDSMN1; SMN2LMNAALDH1A1POLB
SCHEMBL20810045 0.81 LMNA (0.57) SMN1; SMN2LMNAALDH1A1POLBCYP1A2
SCHEMBL20809980 0.81 ALDH1A1 (0.57) HPGDSMN1; SMN2LMNAALDH1A1POLB
SCHEMBL20810147 0.81 KMT2A (0.51) HPGDLMNAPOLBHTTTSHR
SCHEMBL20810065 0.80 SMN1; SMN2 (0.54) HPGDSMN1; SMN2LMNAALDH1A1POLB
SCHEMBL20810214 0.80 SMN1; SMN2 (0.56) HPGDSMN1; SMN2LMNAALDH1A1POLB
SCHEMBL20810070 0.80 SMN1; SMN2 (0.63) HPGDSMN1; SMN2LMNAALDH1A1POLB

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-20190077777-A1 NICOTINIC ACID DERIVATIVES, THEIR PREPARATION AND THE USE THEREOF XIAMEN INSTITUTE OF RARE EARTH MATERIALS (CN) 2019-03-14 — — 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-20190077777-A1 NICOTINIC ACID DERIVATIVES, THEIR PREPARATION AND THE USE THEREOF H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCAR3, NAPRT HPGD 478/4885SMN1; SMN2 2249/4885LMNA 1586/4885

“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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