SCHEMBL19501047

SCHEMBL19501047

C/C=C/C(=O)Nc1ccccc1NC(=O)Nc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.55
▸ MEN1 O00255 5/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ TP53 P04637 1/20 0.55
▸ EPHX1 P07099 1/20 0.55
▸ TSHR P16473 1/20 0.55
▸ EPHX2 P34913 1/20 0.55
▸ CDK9 P50750 1/20 0.55
▸ CLK4 Q9HAZ1 1/20 0.55
▸ NPC1 O15118 5/20 0.54
▸ RAB9A P51151 5/20 0.54
▸ LMNA P02545 3/20 0.54
▸ HTT P42858 2/20 0.54
▸ MAPT P10636 4/20 0.51
▸ KDM4E B2RXH2 3/20 0.51
▸ GAA P10253 2/20 0.50
▸ TAAR1 Q96RJ0 2/20 0.50
▸ RECQL P46063 1/20 0.50
▸ POLB P06746 1/20 0.49
▸ MAPK1 P28482 1/20 0.49

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
SCHEMBL19501011 0.88 SMN1; SMN2 (0.61) KMT2AMEN1SMN1; SMN2TP53EPHX1
SCHEMBL19501829 0.85 HTT (0.68) KMT2AMEN1SMN1; SMN2TP53EPHX1
SCHEMBL529588 0.85 FABP4 (0.49) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL529589 0.85 FABP4 (0.49) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL4147799 0.84 MMP1 (0.63) KMT2AMEN1SMN1; SMN2TP53EPHX1
SCHEMBL4147796 0.84 MMP1 (0.63) KMT2AMEN1SMN1; SMN2TP53EPHX1
SCHEMBL19142994 0.84 MMP1 (0.63) KMT2AMEN1SMN1; SMN2TP53EPHX1
SCHEMBL19500988 0.84 LPAR1 (0.60) KMT2AMEN1SMN1; SMN2TP53EPHX1
SCHEMBL21082016 0.83 MMP1 (0.73) NPC1RAB9AMAOAMAOBEGFR
SCHEMBL19501046 0.83 MMP1 (0.73) NPC1RAB9AMAOAMAOBEGFR

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-10343438-B2 Heat-sensitive recording material NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2019-07-09 — — US disclosed
US-20170297355-A1 Heat-Sensitive Recording Material NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2017-10-19 — — 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 (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-20170297355-A1 Heat-Sensitive Recording Material SCN1A, SCN3A, KCNN3 KMT2A 1505/4885MEN1 1050/4885SMN1; SMN2 219/4885
US-10343438-B2 Heat-sensitive recording material SCN1A, SCN3A, KCNN3 KMT2A 1505/4885MEN1 1050/4885SMN1; SMN2 219/4885

“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.

Send feedback