SCHEMBL19714443

SCHEMBL19714443

COc1ccccc1NC(=O)Cn1c(NCc2ccccc2)nc2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.60
▸ MAPT P10636 3/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ USP2 O75604 1/20 0.56
▸ RAB9A P51151 2/20 0.53
▸ THRB P10828 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.52
▸ MPO P05164 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.52
▸ HTT P42858 2/20 0.51
▸ TSHR P16473 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ PKM P14618 1/20 0.51

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
SCHEMBL19714478 0.86 LMNA (0.74) LMNAMAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL19714285 0.84 POLB (0.59) LMNAMAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL19714625 0.83 TP53 (0.62) LMNAMAPTSMN1; SMN2RAB9APOLB
SCHEMBL19714573 0.83 USP2 (0.61) LMNAMAPTSMN1; SMN2USP2RAB9A
SCHEMBL20715313 0.82 MAPT (0.62) LMNAMAPTCYP2C19ALDH1A1MPO
SCHEMBL19714466 0.80 KMT2A (0.65) LMNAMAPTSMN1; SMN2CYP1A2CYP2D6
SCHEMBL17833385 0.80 LMNA (0.60) LMNAMAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL19714100 0.80 LMNA (0.73) LMNAMAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL17824312 0.79 RAB9A (0.64) LMNAMAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL19714456 0.78 MEN1 (0.54) LMNAMAPTSMN1; SMN2CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170362184-A1 PRO-SURVIVAL COMPOUNDS HERIOT-WATT UNIVERSITY (GB) 2017-12-21 — — 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 (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-20170362184-A1 PRO-SURVIVAL COMPOUNDS MCL1, MKI67, MORF4L1 LMNA 301/4885MAPT 4635/4885SMN1; SMN2 10/4885

“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.

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