SCHEMBL19364800

SCHEMBL19364800

C=CCc1ccc2[nH]c(I)nc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.40
MAPT P10636 6/20 0.39
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
GAA P10253 4/20 0.39
GABRA1 P14867 4/20 0.39
GABRB2 P47870 4/20 0.39
CNR2 P34972 3/20 0.39
KDM4E B2RXH2 3/20 0.39
PPARG P37231 2/20 0.39
PPARD Q03181 2/20 0.39
CNR1 P21554 2/20 0.39
ALDH2 P05091 1/20 0.39
AKR1B1 P15121 1/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PPARA Q07869 1/20 0.37
CYP3A4 P08684 3/20 0.36
CYP1A2 P05177 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
SCHEMBL889003 0.81 ALDH1A1 (0.40) XDHMAPTALDH1A1MEN1KMT2A
SCHEMBL19364508 0.78 HSD17B10 (0.40) PARP1
SCHEMBL19364507 0.78 GAA (0.43) MAPTGAAALOX5SMN1; SMN2LMNA
SCHEMBL19364506 0.78 CBFB (0.39) MAPTMEN1KMT2A
SCHEMBL19364711 0.75 RAD52 (0.43) MAPTALDH1A1GAAKDM4ECYP1A2
SCHEMBL19364504 0.75 KDM4E (0.39) MAPTALDH1A1GAAKDM4EALOX5
SCHEMBL19364799 0.75 TYMS (0.36) MAPTALDH1A1
SCHEMBL19364710 0.74 KDM4E (0.30) KDM4E
SCHEMBL10147756 0.73
SCHEMBL19364709 0.72 CA1 (0.37) ALDH1A1KDM4EHPGD

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-10752611-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2020-08-25 US disclosed
US-9765087-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2017-09-19 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-10752611-B2 Benzimidazole derivatives EIF2AK2, ZC3HAV1, ZC3HAV1L XDH 2277/4885MAPT 4391/4885ALDH1A1 132/4885

“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.