SCHEMBL16637613

SCHEMBL16637613

COc1ccc2cn(-c3nccc(Nc4ccc(Br)cc4)n3)cc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 4/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49
RAB9A P51151 1/20 0.49
ROCK1 Q13464 3/20 0.46
CCNE1 P24864 5/20 0.43
CDK2 P24941 5/20 0.43
GALR2 O43603 2/20 0.43
EGFR P00533 1/20 0.43
TNF P01375 1/20 0.41
IGF1R P08069 1/20 0.41
KDR P35968 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
CDK4 P11802 1/20 0.40

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
SCHEMBL16637714 0.88 ROCK2 (0.56) ROCK2MEN1KMT2ANPC1ALDH1A1
SCHEMBL16637607 0.86 ROCK2 (0.66) ROCK2MEN1KMT2ANPC1ALDH1A1
SCHEMBL16637772 0.82 ROCK2 (0.69) ROCK2ROCK1CDK2KDR
SCHEMBL17164484 0.80 ROCK2 (0.69) ROCK2ROCK1IGF1RKDR
SCHEMBL16637615 0.79 ROCK2 (0.77) ROCK2MEN1KMT2ANPC1ALDH1A1
SCHEMBL16637702 0.75 ROCK2 (0.44) ROCK2MEN1KMT2ANPC1ALDH1A1
SCHEMBL16637498 0.73 NCF1 (0.50) NPC1RAB9AROCK1EGFR
SCHEMBL20769696 0.71 NQO1 (0.52) MEN1KMT2ANPC1ALDH1A1MAPT
SCHEMBL22229790 0.68 PLAU (0.43) MAPTRAB9AROCK1KDR
SCHEMBL25630336 0.67 MAPK8 (0.52) ROCK2ROCK1CCNE1CDK2GALR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260034127-A1 TREATMENT OF GVHD KADMON CORP LLC (FR) 2026-02-05 US disclosed
US-20220395501-A1 TREATMENT OF GVHD KADMON CORP LLC (US) 2022-12-15 US disclosed
US-11311541-B2 Treatment of GVHD KADMON CORPORATION, LLC (US) 2022-04-26 US disclosed
EP-3055301-B1 (2-(5-ISOINDOLIN-2-YL)PYRIMIDIN-4-YL)-AMINE DERIVATIVES AS RHO KINASE INHIBITORS FOR TREATING AUTOIMMUNE DISEASES KADMON CORP LLC (US) 2019-11-20 EP disclosed
US-10125144-B2 Rho kinase inhibitors KADMON CORPORATION, LLC (US) 2018-11-13 US disclosed
US-20170112832-A1 TREATMENT OF GVHD KADMON CORPORATION, LLC 2017-04-27 US disclosed
US-20160237095-A1 RHO KINASE INHIBITORS KADMON CORPORATION, LLC 2016-08-18 US disclosed
EP-3055301-A1 RHO KINASE INHIBITORS Kadmon Corporation, LLC (US) 2016-08-17 EP disclosed
WO-2015157556-A1 TREATMENT OF GVHD KADMON CORPORATION, LLC (US) 2015-10-15 WO disclosed
WO-2015054317-A1 RHO KINASE INHIBITORS KADMON CORPORATION, LLC (US) 2015-04-16 WO 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 (6 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-20160237095-A1 RHO KINASE INHIBITORS ROCK2, ROCK1, RHOA ROCK2 1/4885MEN1 776/4885KMT2A 1466/4885
US-20260034127-A1 TREATMENT OF GVHD ROCK2, RHOA, MYH2 ROCK2 1/4885MEN1 3775/4885KMT2A 752/4885
US-10125144-B2 Rho kinase inhibitors ROCK2, ROCK1, RHOA ROCK2 1/4885MEN1 776/4885KMT2A 1466/4885
US-20170112832-A1 TREATMENT OF GVHD ROCK2, ROCK1, RHOA ROCK2 1/4885MEN1 3586/4885KMT2A 106/4885
US-20220395501-A1 TREATMENT OF GVHD ROCK2, ROCK1, RHOXF2 ROCK2 1/4885MEN1 3628/4885KMT2A 139/4885
US-11311541-B2 Treatment of GVHD ROCK2, ROCK1, RHOA ROCK2 1/4885MEN1 3586/4885KMT2A 106/4885

“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.