SCHEMBL1607435

SCHEMBL1607435

O=C(c1c[nH]c2ccccc12)C(Cl)(Cl)Cl

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.70
GPR84 Q9NQS5 1/20 0.65
ALDH1A1 P00352 2/20 0.61
PBRM1 Q86U86 1/20 0.61
ATM Q13315 1/20 0.61
KMT2A Q03164 3/20 0.57
NR4A2 P43354 2/20 0.56
CREBBP Q92793 1/20 0.56
MEN1 O00255 2/20 0.54
ADAM17 P78536 1/20 0.53
HTR3E A5X5Y0 1/20 0.53
HTR3B O95264 1/20 0.53
HTR3A P46098 1/20 0.53
HTR3D Q70Z44 1/20 0.53
HTR3C Q8WXA8 1/20 0.53
CTNNB1 P35222 3/20 0.51
WNT3A P56704 3/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
PIM1 P11309 1/20 0.50

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
SCHEMBL2828218 0.86 MAPK1 (0.76) MAPK1GPR84ALDH1A1PBRM1ATM
SCHEMBL28059877 0.85 MAPK1 (0.74) MAPK1GPR84ALDH1A1PBRM1ATM
SCHEMBL28327861 0.83 GPR84 (0.61) MAPK1GPR84ALDH1A1PBRM1ATM
SCHEMBL2040397 0.82 MAPK1 (1.00) MAPK1GPR84ALDH1A1PBRM1ATM
SCHEMBL13543217 0.82 MAPK1 (0.70) MAPK1GPR84ALDH1A1PBRM1ATM
SCHEMBL31530832 0.81 MAPK1 (0.68) MAPK1GPR84ALDH1A1PBRM1ATM
SCHEMBL30353966 0.79 GPR84 (0.71) MAPK1GPR84ALDH1A1PBRM1ATM
SCHEMBL72811 0.79 GPR84 (0.71) MAPK1GPR84ALDH1A1PBRM1ATM
SCHEMBL64182 0.79 GPR84 (0.77) MAPK1GPR84ALDH1A1PBRM1ATM
SCHEMBL2028344 0.79 GPR84 (1.00) MAPK1GPR84ALDH1A1PBRM1ATM

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
CN-105481753-A 3-indole carboxylic acid preparation method CHONGQING TIANYI HENGHUA TECH CO LTD 2016-04-13 CN disclosed
US-8148413-B2 N-heteroaryl indole carboxamides and analogues thereof, for use as glucokinase activators in the treatment of diabetes TRANSTECH PHARMA, INC. (US) 2012-04-03 US disclosed
US-20110082144-A1 N-HETEROARYL INDOLE CARBOXAMIDES AND ANALOGUES THEREOF, FOR USE AS GLUCOKINASE ACTIVATORS IN THE TREATMENT OF DIABETES TRANSTECH PHARMA, INC. (US) 2011-04-07 US disclosed
US-7812043-B2 N-heteroaryl indole carboxamides and analogues thereof, for use as glucokinase activators in the treatment of diabetes TRANSTECH PHARMA, INC. (US) 2010-10-12 US disclosed
US-20070027140-A1 N-heteroaryl indole carboxamides and analogues thereof, for use as glcokinase activators in the treatment of diabetes NOVO NORDISK A/S (DK) 2007-02-01 US disclosed
EP-1689392-A1 N-HETEROARYL INDOLE CARBOXAMIDES AND ANALOGUES THEREOF, FOR USE AS GLUCOKINASE ACTIVATORS IN THE TREATMENT OF DIABETES NOVO NORDISK A/S (DK) 2006-08-16 EP disclosed
WO-2005049019-A1 N-HETEROARYL INDOLE CARBOXAMIDES AND ANALOGUES THEREOF, FOR USE AS GLUCOKINASE ACTIVATORS IN THE TREATMENT OF DIABETES NOVO NORDISK A/S (DK) 2005-06-02 WO disclosed
EP-1532980-A1 N-heteroaryl indole carboxamides and analogues thereof, for use as glucokinase activators in the treatment of diabetes NOVO NORDISK A/S (DK) 2005-05-25 EP disclosed
EP-0266308-B1 INDOLO-PYRAZINO-BENZODIAZEPINE DERIVATIVES CIBA-GEIGY AG (CH) 1991-07-24 EP disclosed
EP-0266308-A1 Indolo-pyrazino-benzodiazepine derivatives CIBA-GEIGY AG (CH) 1988-05-04 EP disclosed
US-4737496-A ANXIOLYTIC AGENTS CIBA-GEIGY CORPORATION (US) 1988-04-12 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-20070027140-A1 N-heteroaryl indole carboxamides and analogues thereof, for use as glcokinase activators in the treatment of diabetes GALK1, GCKR, GCK MAPK1 1672/4885GPR84 720/4885ALDH1A1 2638/4885
US-20110082144-A1 N-HETEROARYL INDOLE CARBOXAMIDES AND ANALOGUES THEREOF, FOR USE AS GLUCOKINASE ACTIVATORS IN THE TREATMENT OF DIABETES GCKR, GCK, GALK1 MAPK1 1630/4885GPR84 759/4885ALDH1A1 1240/4885

“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.