SCHEMBL1336743

SCHEMBL1336743

COc1ccc(Cl)c(-c2ccc(N)c(F)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.47
HSP90AB1 P08238 2/20 0.47
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 2/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
CYP2C19 P33261 1/20 0.40
KIT P10721 1/20 0.39
GSTP1 P09211 1/20 0.38
KDM1A O60341 1/20 0.38
METAP2 P50579 1/20 0.38
CTSD P07339 4/20 0.38
BACE1 P56817 4/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
THRB P10828 2/20 0.38
KMT2A Q03164 2/20 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
SCHEMBL1337807 0.84 HSP90AA1 (0.49) HSP90AA1HSP90AB1ALDH1A1CYP3A4CYP1A2
SCHEMBL1337734 0.82 HSP90AA1 (0.47) HSP90AA1HSP90AB1ALDH1A1CYP3A4CYP1A2
SCHEMBL18691958 0.80 CYP3A4 (0.47) HSP90AA1HSP90AB1ALDH1A1CYP3A4CYP1A2
SCHEMBL1337556 0.79 HSP90AA1 (0.53) HSP90AA1HSP90AB1ALDH1A1CYP3A4CYP1A2
SCHEMBL7777278 0.78 HSP90AA1 (0.50) HSP90AA1HSP90AB1CYP1A2CYP2D6CYP2C9
SCHEMBL112473 0.78 ALDH1A1 (0.57) ALDH1A1CYP3A4CYP1A2BACE1MEN1
Hydrochloric Acid SCHEMBL1682378 0.76 ALDH1A1 (0.61) ALDH1A1CYP3A4CYP1A2BACE1MEN1
SCHEMBL16290750 0.76 HSP90AA1 (0.45) HSP90AA1HSP90AB1ALDH1A1CYP3A4CYP1A2
SCHEMBL15011871 0.75 CYP1A1 (0.47) HSP90AA1HSP90AB1ALDH1A1CYP3A4CYP1A2
SCHEMBL31509776 0.74 SMN1; SMN2 (0.51) HSP90AA1HSP90AB1SCN10AKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2566847-B1 NOVEL IMMUNOMODULATOR AND ANTI INFLAMMATORY COMPOUNDS ICOZEN THERAPEUTICS PVT LTD (IN) 2018-11-07 EP disclosed
US-9758474-B2 Immunomodulator and anti-inflammatory compounds INCOZEN THERAPEUTICS PVT. LTD. (IN) 2017-09-12 US disclosed
US-20140220050-A1 NOVEL IMMUNOMODULATOR AND ANTI-INFLAMMATORY COMPOUNDS INCOZEN THERAPEUTICS PVT. LTD. (CH) 2014-08-07 US disclosed
US-20110275603-A1 NOVEL IMMUNOMODULATOR AND ANTI-INFLAMMATORY COMPOUNDS RHIZEN PHARMACEUTICALS SA (FR) 2011-11-10 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 (2 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-20140220050-A1 NOVEL IMMUNOMODULATOR AND ANTI-INFLAMMATORY COMPOUNDS DHODH, DLD, DHFR HSP90AA1 547/4885HSP90AB1 479/4885ALDH1A1 109/4885
US-20110275603-A1 NOVEL IMMUNOMODULATOR AND ANTI-INFLAMMATORY COMPOUNDS DHODH, DLD, DHFR HSP90AA1 547/4885HSP90AB1 479/4885ALDH1A1 109/4885

“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.