SCHEMBL20176200

SCHEMBL20176200

CCOC(=O)c1sc(-c2ccc(-c3ccc(-c4cc5cc6sc(-c7ccc(-c8ccc(-c9nc(C(F)(F)F)c(C(=O)OCC)s9)s8)s7)cc6cc5s4)s3)s2)nc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 3/20 0.47
CDC7 O00311 2/20 0.47
DBF4 Q9UBU7 2/20 0.47
MAPT P10636 5/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
HSP90AA1 P07900 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
DHODH Q02127 2/20 0.39
P2RY1 P47900 1/20 0.39
TRPM8 Q7Z2W7 3/20 0.38
NPC1 O15118 3/20 0.38
HPGD P15428 3/20 0.38
RAB9A P51151 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CASP1 P29466 1/20 0.38

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
SCHEMBL20181224 0.96 KDM4E (0.46) KDM4EALDH1A1LMNACDC7DBF4
SCHEMBL290062 0.87 JAK2 (0.46) KDM4EALDH1A1LMNACDC7DBF4
SCHEMBL289679 0.82 KDM4E (0.53) KDM4EALDH1A1LMNACDC7DBF4
SCHEMBL289509 0.82 KDM4E (0.55) KDM4EALDH1A1LMNACDC7DBF4
SCHEMBL288852 0.81 KDM4E (0.59) KDM4EALDH1A1LMNACDC7DBF4
SCHEMBL289947 0.81 ALDH1A1 (0.53) KDM4EALDH1A1LMNACDC7DBF4
SCHEMBL300086 0.79 KDM4E (0.49) KDM4EALDH1A1LMNACDC7DBF4
SCHEMBL290278 0.78 KDM4E (0.66) KDM4EALDH1A1LMNACDC7DBF4
SCHEMBL289583 0.77 KDM4E (0.65) KDM4EALDH1A1LMNACDC7DBF4
SCHEMBL290128 0.76 MAPT (0.69) KDM4EALDH1A1LMNACDC7DBF4

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-20180144877-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, AND COMPOUND FUJIFILM CORPORATION (JP) 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 (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-20180144877-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, AND COMPOUND SLC9A1, SLC9A2, SLC26A3 KDM4E 1813/4885ALDH1A1 2172/4885LMNA 1019/4885

“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.