SCHEMBL20183647

SCHEMBL20183647

CCn1c(=O)cc(C2CCN(CCO)CC2)c2cc(C(=O)N(C)c3ccc4c(c3)CCCCC4)ccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.37
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
KMT2A Q03164 3/20 0.35
KDM2B Q8NHM5 1/20 0.35
MAPT P10636 1/20 0.34
CSF1R P07333 1/20 0.34
ALDH1A1 P00352 2/20 0.33
ITK Q08881 1/20 0.33
MEN1 O00255 2/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
THRB P10828 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
MMP14 P50281 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RAB9A P51151 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
SCHEMBL20183634 0.99 MCHR1 (0.36) MCHR1RXRARXRBRXRGKMT2A
SCHEMBL20183615 0.92 RXRA (0.38) MCHR1RXRARXRBRXRGKMT2A
SCHEMBL20183834 0.90 RXRA (0.38) RXRARXRBRXRGKMT2AKDM2B
SCHEMBL20183785 0.86 KDM4E (0.43) ALDH1A1ITKLMNASMN1; SMN2KDM4E
SCHEMBL20183853 0.84 LMNA (0.38) MCHR1ALDH1A1ITKLMNASMN1; SMN2
SCHEMBL20183847 0.80 KCNH2 (0.39) KMT2AMAPTALDH1A1MEN1LMNA
SCHEMBL20183635 0.80 BRD4 (0.43) MAPTALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL20788161 0.79 HSP90AA1 (0.34) KMT2AMAPTCSF1RALDH1A1MEN1
SCHEMBL20183878 0.79 KDM4E (0.46) KMT2AMAPTALDH1A1MEN1LMNA
SCHEMBL20183682 0.79 KDM4E (0.46) KMT2AMAPTALDH1A1ITKMEN1

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 11 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
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
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 MCHR1 2475/4885RXRA 1441/4885RXRB 1808/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 MCHR1 1846/4885RXRA 2318/4885RXRB 2389/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 MCHR1 2475/4885RXRA 1441/4885RXRB 1808/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 MCHR1 1846/4885RXRA 2318/4885RXRB 2389/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 MCHR1 1888/4885RXRA 848/4885RXRB 1111/4885

“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.