SCHEMBL19145310

SCHEMBL19145310

C/C=N\C(=C/C)Nc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ TAS2R38 P59533 3/20 0.43
▸ HSD17B10 Q99714 3/20 0.43
▸ NAPRT Q6XQN6 1/20 0.43
▸ TP53 P04637 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ EPHX1 P07099 1/20 0.41
▸ EPHX2 P34913 1/20 0.41
▸ CDK9 P50750 1/20 0.41
▸ CLK4 Q9HAZ1 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ GAA P10253 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TGM2 P21980 1/20 0.39
▸ KMT2A Q03164 3/20 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
SCHEMBL20143330 0.81 TGM2 (0.43) SMN1; SMN2TAS2R38HSD17B10NAPRTTP53
SCHEMBL2914537 0.78 NAPRT (0.52) SMN1; SMN2HSD17B10NAPRTTP53TSHR
SCHEMBL18464422 0.72 SMN1; SMN2 (0.39) SMN1; SMN2TAS2R38HSD17B10NAPRTTP53
SCHEMBL11183534 0.71 MTOR (0.47) SMN1; SMN2HSD17B10NAPRTTP53TSHR
SCHEMBL5157140 0.70 TAS2R38 (0.52) SMN1; SMN2TAS2R38HSD17B10NAPRTTP53
SCHEMBL18676955 0.70 TAS2R38 (0.52) SMN1; SMN2TAS2R38HSD17B10NAPRTTP53
SCHEMBL13513997 0.70 NPC1 (0.53) SMN1; SMN2HSD17B10NAPRTTP53TSHR
SCHEMBL12113186 0.69 MAPT (0.61) SMN1; SMN2TAS2R38HSD17B10NAPRTTP53
SCHEMBL12440049 0.69 MAPT (0.61) SMN1; SMN2TAS2R38HSD17B10NAPRTTP53
SCHEMBL9253909 0.69 MAPT (0.61) SMN1; SMN2TAS2R38HSD17B10NAPRTTP53

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-10717724-B2 Compounds useful for treating cancer ABIVAX (FR) 2020-07-21 — — US disclosed
US-20180222888-A1 COMPOUNDS USEFUL FOR TREATING CANCER ABIVAX (FR) 2018-08-09 — — US disclosed
US-20170207396-A1 ORGANIC ELECTROLUMINESCENT DEVICE ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2017-07-20 — — 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 (2 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-20180222888-A1 COMPOUNDS USEFUL FOR TREATING CANCER PRMT7, PRMT6, RRM2 SMN1; SMN2 1893/4885TAS2R38 1224/4885HSD17B10 2740/4885
US-10717724-B2 Compounds useful for treating cancer PRMT7, PRMT6, RRM2 SMN1; SMN2 1893/4885TAS2R38 1224/4885HSD17B10 2740/4885

“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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