SCHEMBL20183487

SCHEMBL20183487

CCn1c(=O)cc(C2CC2)c2cc(C(=O)N(C)c3ccccc3C)ccc21

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
TP53 P04637 1/20 0.41
THRB P10828 1/20 0.40
ALDH1A1 P00352 6/20 0.39
TSHR P16473 2/20 0.39
PTGER4 P35408 1/20 0.39
KDM4E B2RXH2 3/20 0.38
NPSR1 Q6W5P4 2/20 0.37
PLAT P00750 1/20 0.36
RAB9A P51151 1/20 0.36
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL20183612 0.89 ALDH1A1 (0.52) POLBTP53ALDH1A1TSHRPTGER4
SCHEMBL20183506 0.89 ALDH1A1 (0.38) POLBTHRBALDH1A1TSHRPTGER4
SCHEMBL20183528 0.87 KDM4E (0.48) POLBALDH1A1TSHRPTGER4KDM4E
SCHEMBL20183762 0.87 ALDH1A1 (0.39) POLBALDH1A1TSHRPTGER4KDM4E
SCHEMBL20183576 0.87 ALDH1A1 (0.40) POLBALDH1A1TSHRPTGER4KDM4E
SCHEMBL20806266 0.86 HTR3E (0.39) POLBTP53ALDH1A1TSHRPTGER4
SCHEMBL20183593 0.84 BRD4 (0.43) TP53ALDH1A1TSHRPTGER4KDM4E
SCHEMBL20183725 0.83 HSD17B1 (0.44) TP53THRBALDH1A1PTGER4KDM4E
SCHEMBL20183811 0.83 ALDH1A1 (0.42) ALDH1A1TSHRPTGER4KDM4ERAB9A
SCHEMBL20183713 0.83 ALDH1A1 (0.40) ALDH1A1TSHRPTGER4KDM4ENPSR1

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 15 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
EP-3327004-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND FUJIFILM CORP (JP) 2020-11-04 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
EP-3563851-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR FUJIFILM Corporation (JP) 2019-11-06 EP 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
WO-2018124180-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR 富士フイルム株式会社 2018-07-05 WO 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 POLB 2400/4885TP53 94/4885THRB 2119/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 POLB 2919/4885TP53 1844/4885THRB 3326/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 POLB 2400/4885TP53 94/4885THRB 2119/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 POLB 2919/4885TP53 1844/4885THRB 3326/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 POLB 3220/4885TP53 1821/4885THRB 2871/4885

“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.