SCHEMBL20182754

SCHEMBL20182754

CCCCC1Nc2ccccc2S1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.46
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
TP53 P04637 3/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 3/20 0.34
HSD17B10 Q99714 3/20 0.34
CYP3A4 P08684 2/20 0.34
RAB9A P51151 2/20 0.34
MAPK1 P28482 2/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HPGD P15428 1/20 0.34
PTGS1 P23219 1/20 0.34
NAPRT Q6XQN6 1/20 0.34

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
SCHEMBL10741925 0.93 IDO1 (0.43) IDO1KDM4EMEN1KMT2ABRD4
SCHEMBL10738044 0.89 IDO1 (0.48) IDO1KDM4EMEN1KMT2ABRD4
SCHEMBL5437237 0.82 IDO1 (0.52) IDO1KDM4EMEN1KMT2ABRD4
SCHEMBL31403242 0.77 IDO1 (0.55) IDO1KDM4EMEN1KMT2ABRD4
SCHEMBL28272092 0.77 IDO1 (0.38) IDO1KDM4EMEN1KMT2ABRD4
SCHEMBL395007 0.75 IDO1 (0.44) IDO1MEN1KMT2ABRD4CREBBP
SCHEMBL27783946 0.74 IDO1 (0.38) IDO1KDM4EMEN1KMT2ABRD4
SCHEMBL20646066 0.74 IDO1 (0.47) IDO1KDM4EMEN1KMT2ABRD4
SCHEMBL20751699 0.74 IDO1 (0.47) IDO1KDM4EMEN1KMT2ABRD4
Sulfuric Acid SCHEMBL9171022 0.73 IDO1 (0.43) IDO1KDM4EMEN1KMT2ABRD4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3458511-B1 POLYMERIC MATERIAL COMPRISING MODIFIED LIGNIN REN COM AB (SE) 2021-07-28 EP disclosed
US-10851245-B2 Polymeric material comprising modified lignin REN COM AB 2020-12-01 US disclosed
US-10676688-B2 Composition comprising derivatized lignin for fuel production REN FUEL K2B AB (SE) 2020-06-09 US disclosed
US-20190233648-A1 POLYMERIC MATERIAL COMPRISING MODIFIED LIGNIN LIGNIN INDUSTRIES AB (SE) 2019-08-01 US disclosed
US-20180142177-A1 COMPOSITION COMPRISING DERIVATIZED LIGNIN FOR FUEL PRODUCTION REN FUEL K2B AB (SE) 2018-05-24 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-20180142177-A1 COMPOSITION COMPRISING DERIVATIZED LIGNIN FOR FUEL PRODUCTION NOX4, DCXR, COXFA4 IDO1 4027/4885KDM4E 224/4885MEN1 4810/4885
US-10676688-B2 Composition comprising derivatized lignin for fuel production NOX4, DCXR, COXFA4 IDO1 4027/4885KDM4E 224/4885MEN1 4810/4885

“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.