SCHEMBL20183848

SCHEMBL20183848

CCn1c(=O)cc(C2CC2)c2cc(N(C)C(=O)c3ccc(NS(C)(=O)=O)cc3)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 2/20 0.38
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
TSHR P16473 1/20 0.35
HPGD P15428 1/20 0.35
RECQL P46063 1/20 0.35
NPC1 O15118 2/20 0.35
GPR119 Q8TDV5 1/20 0.35
HTT P42858 1/20 0.34
KDM4E B2RXH2 1/20 0.34
RAB9A P51151 1/20 0.34
RORC P51449 3/20 0.34
EPHX2 P34913 1/20 0.34
NR1H4 Q96RI1 1/20 0.34
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33

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
SCHEMBL20183665 0.91 ALDH1A1 (0.38) NR3C2OPRM1OPRD1OPRK1SMN1; SMN2
SCHEMBL20183564 0.88 ALDH1A1 (0.35) HPGDRECQLHTTKDM4ERAB9A
SCHEMBL20183805 0.88 ALDH1A1 (0.37) SMN1; SMN2TSHRHPGDHTTKDM4E
SCHEMBL20183767 0.87 HTT (0.43) HPGDNPC1HTTALDH1A1
SCHEMBL20183518 0.87 BRD4 (0.39) SMN1; SMN2HPGDKDM4ERAB9ARORC
SCHEMBL20183680 0.87 MCHR1 (0.39) TSHRHPGDHTTKDM4ERAB9A
SCHEMBL20183795 0.86 KDM4E (0.38) HTTKDM4ERORCALDH1A1
SCHEMBL20183620 0.86 ITK (0.38) TSHRHTTKDM4ERORCALDH1A1
SCHEMBL20183710 0.86 SMN1; SMN2 (0.37) SMN1; SMN2TSHRHPGDKDM4ERAB9A
SCHEMBL20183493 0.86 MAPT (0.37) SMN1; SMN2HPGDNPC1HTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10987349-B2 Antitumor agent and bromodomain inhibitor FUJIFILM CORPORATION (JP) 2021-04-27 US disclosed
US-10987349-B2 Antitumor agent and bromodomain inhibitor FUJIFILM CORPORATION (JP) 2021-04-27 US disclosed
EP-3563851-B1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR FUJIFILM CORP (JP) 2021-04-21 EP disclosed
US-10696637-B2 Nitrogen-containing heterocyclic compound FUJIFILM CORPORATION (JP) 2020-06-30 US disclosed
US-10696637-B2 Nitrogen-containing heterocyclic compound FUJIFILM CORPORATION (JP) 2020-06-30 US disclosed
US-10633343-B2 2020-04-28 US disclosed
US-10633343-B2 2020-04-28 US disclosed
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR FUJIFILM CORPORATION (JP) 2019-10-17 US disclosed
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR FUJIFILM CORPORATION (JP) 2019-10-17 US disclosed
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND FUJIFILM CORPORATION (JP) 2019-03-14 US disclosed
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND FUJIFILM CORPORATION (JP) 2019-03-14 US disclosed
EP-3327004-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND Fujifilm Corporation (JP) 2018-05-30 EP 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 (5 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-10987349-B2 Antitumor agent and bromodomain inhibitor BRD4, BRD1, BRD3 NR3C2 1167/4885OPRM1 2808/4885OPRD1 2030/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 NR3C2 193/4885OPRM1 623/4885OPRD1 817/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 NR3C2 1167/4885OPRM1 2808/4885OPRD1 2030/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 NR3C2 193/4885OPRM1 623/4885OPRD1 817/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 NR3C2 119/4885OPRM1 1081/4885OPRD1 1222/4885

“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.