SCHEMBL19209337

SCHEMBL19209337

C/C(Br)=C(/C=C/C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.50
MAPT P10636 7/20 0.48
LMNA P02545 5/20 0.48
PLIN1 O60240 2/20 0.48
PLIN5 Q00G26 2/20 0.48
ABHD5 Q8WTS1 2/20 0.48
BCHE P06276 2/20 0.48
TNFRSF1A P19438 1/20 0.48
ACHE P22303 1/20 0.48
MAOB P27338 1/20 0.48
CYP1B1 Q16678 1/20 0.48
RAB9A P51151 5/20 0.46
NPC1 O15118 4/20 0.46
POLB P06746 1/20 0.46
ALDH1A1 P00352 8/20 0.46
HPGD P15428 4/20 0.46
CYP3A4 P08684 3/20 0.46
AKT1 P31749 2/20 0.46
MAPK1 P28482 2/20 0.45
TDP1 Q9NUW8 2/20 0.45

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
SCHEMBL19243107 1.00 RECQL (0.50) RECQLMAPTLMNAPLIN1PLIN5
SCHEMBL19209338 1.00 RECQL (0.50) RECQLMAPTLMNAPLIN1PLIN5
SCHEMBL19243284 0.92 CYP1B1 (0.55) RECQLMAPTLMNACYP1B1RAB9A
SCHEMBL20677797 0.92 CYP1B1 (0.55) RECQLMAPTLMNACYP1B1RAB9A
SCHEMBL20684803 0.92 MAPT (0.49) RECQLMAPTLMNAPLIN1PLIN5
SCHEMBL20677763 0.92 MAPT (0.49) RECQLMAPTLMNAPLIN1PLIN5
SCHEMBL20677758 0.92 ALDH1A1 (0.59) RECQLMAPTLMNACYP1B1RAB9A
SCHEMBL20677761 0.92 MAPT (0.49) RECQLMAPTLMNAPLIN1PLIN5
SCHEMBL19243167 0.92 ALDH1A1 (0.59) RECQLMAPTLMNACYP1B1RAB9A
SCHEMBL20684800 0.91 MAOB (0.54) RECQLMAPTLMNAMAOBCYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190031665-A1 DERIVATIVES OF PYRROLOIMIDAZOLE OR ANALOGUES THEREOF WHICH ARE USEFUL FOR THE TREATMENT OF INTER ALIA CANCER EMCURE PHARMACEUTICALS LIMITED (IN) 2019-01-31 US disclosed
EP-3400226-A1 DERIVATIVES OF PYRROLOIMIDAZOLE OR ANALOGUES THEREOF WHICH ARE USEFUL FOR THE TREATMENT OF INTER ALIA CANCER Emcure Pharmaceuticals Limited (IN) 2018-11-14 EP disclosed
WO-2017134555-A1 DERIVATIVES OF PYRROLOIMIDAZOLE OR ANALOGUES THEREOF WHICH ARE USEFUL FOR THE TREATMENT OF INTER ALIA CANCER EMCURE PHARMACEUTICALS LIMITED (IN) 2017-08-10 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 (1 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-20190031665-A1 DERIVATIVES OF PYRROLOIMIDAZOLE OR ANALOGUES THEREOF WHICH ARE USEFUL FOR THE TREATMENT OF INTER ALIA CANCER IDO1, IDO2, TDO2 RECQL 1980/4885MAPT 3786/4885LMNA 4454/4885

“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.